[2-[[(1R,2R)-2-hydroxy-4-(pyrazol-1-ylmethyl)cyclopentyl]amino]-3-pyridinyl]-pyrrolidin-1-ylmethanone

C19H25N5O2 — CID 154798355

IUPAC[2-[[(1R,2R)-2-hydroxy-4-(pyrazol-1-ylmethyl)cyclopentyl]amino]-3-pyridinyl]-pyrrolidin-1-ylmethanone
SMILESO=C(c1cccnc1N[C@@H]1CC(Cn2cccn2)C[C@H]1O)N1CCCC1
InChIInChI=1S/C19H25N5O2/c25-17-12-14(13-24-10-4-7-21-24)11-16(17)22-18-15(5-3-6-20-18)19(26)23-8-1-2-9-23/h3-7,10,14,16-17,25H,1-2,8-9,11-13H2,(H,20,22)/t14?,16-,17-/m1/s1
InChIKeyGLBCYUPTMGFOSY-VNCLPFQGSA-N
MW355.44 g/mol
LogP1.77
Rot. Bonds5

About [2-[[(1R,2R)-2-hydroxy-4-(pyrazol-1-ylmethyl)cyclopentyl]amino]-3-pyridinyl]-pyrrolidin-1-ylmethanone

[2-[[(1R,2R)-2-hydroxy-4-(pyrazol-1-ylmethyl)cyclopentyl]amino]-3-pyridinyl]-pyrrolidin-1-ylmethanone (PubChem CID 154798355) has the molecular formula C19H25N5O2 and a molecular weight of 355.44 g/mol. Its IUPAC name is [2-[[(1R,2R)-2-hydroxy-4-(pyrazol-1-ylmethyl)cyclopentyl]amino]-3-pyridinyl]-pyrrolidin-1-ylmethanone.

Molecular Properties

Compound Name[2-[[(1R,2R)-2-hydroxy-4-(pyrazol-1-ylmethyl)cyclopentyl]amino]-3-pyridinyl]-pyrrolidin-1-ylmethanone
PubChem CID154798355
Molecular FormulaC19H25N5O2
Molecular Weight355.44 g/mol
Exact Mass355.20
IUPAC Name[2-[[(1R,2R)-2-hydroxy-4-(pyrazol-1-ylmethyl)cyclopentyl]amino]-3-pyridinyl]-pyrrolidin-1-ylmethanone
SMILESO=C(c1cccnc1N[C@@H]1CC(Cn2cccn2)C[C@H]1O)N1CCCC1
InChIInChI=1S/C19H25N5O2/c25-17-12-14(13-24-10-4-7-21-24)11-16(17)22-18-15(5-3-6-20-18)19(26)23-8-1-2-9-23/h3-7,10,14,16-17,25H,1-2,8-9,11-13H2,(H,20,22)/t14?,16-,17-/m1/s1
InChIKeyGLBCYUPTMGFOSY-VNCLPFQGSA-N
XLogP1.77
TPSA83.28 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500355.44
LogP ≤ 51.77
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

trans-(1R,2R)-2-[(3-chloro-4-methyl-2-pyridinyl)amino]-4-(pyrazol-1-ylmethyl)cyclopentan-1-ol
CID 167781265
N-[(1R,2R)-2-hydroxy-4-(pyrazol-1-ylmethyl)cyclopentyl]quinoxaline-5-carboxamide
CID 146113903
N-[(1R,2R)-2-hydroxy-4-(pyrazol-1-ylmethyl)cyclopentyl]isoquinoline-1-carboxamide
CID 166286123
N-[(1R,2R)-2-hydroxy-4-(pyrazol-1-ylmethyl)cyclopentyl]-6-pyrrolidin-1-ylpyrimidine-4-carboxamide
CID 146113881
N-[(1R,2R)-2-hydroxy-4-(pyrazol-1-ylmethyl)cyclopentyl]-4-pyridin-2-ylbutanamide
CID 146110013
(2-bromophenyl)-[4-(pyrazol-1-ylmethyl)piperidin-1-yl]methanone
CID 90494885
trans-(1R,2R)-2-[(2,6-dicyclopropylpyrimidin-4-yl)amino]-4-(pyrazol-1-ylmethyl)cyclopentan-1-ol
CID 167878720
[2-[[(3S,4R)-4-methoxypiperidin-3-yl]amino]-3-pyridinyl]-pyrrolidin-1-ylmethanone;dihydrochloride
CID 154916294
(2-aminophenyl)-[4-(pyrazol-1-ylmethyl)piperidin-1-yl]methanone;dihydrochloride
CID 119947130
[2-(ethylamino)-3-pyridinyl]-(4-methyl-1,4-diazepan-1-yl)methanone
CID 62187064
N-[(1R,2R)-2-hydroxy-4-(pyrazol-1-ylmethyl)cyclopentyl]-1H-indole-7-carboxamide
CID 146110002
trans-(1R,2R)-4-(pyrazol-1-ylmethyl)-2-[(1-pyridin-2-ylpiperidin-4-yl)amino]cyclopentan-1-ol
CID 146113945

Frequently Asked Questions

What is the IUPAC name of [2-[[(1R,2R)-2-hydroxy-4-(pyrazol-1-ylmethyl)cyclopentyl]amino]-3-pyridinyl]-pyrrolidin-1-ylmethanone?
The IUPAC name of [2-[[(1R,2R)-2-hydroxy-4-(pyrazol-1-ylmethyl)cyclopentyl]amino]-3-pyridinyl]-pyrrolidin-1-ylmethanone (CID 154798355) is [2-[[(1R,2R)-2-hydroxy-4-(pyrazol-1-ylmethyl)cyclopentyl]amino]-3-pyridinyl]-pyrrolidin-1-ylmethanone.
What is the SMILES notation for [2-[[(1R,2R)-2-hydroxy-4-(pyrazol-1-ylmethyl)cyclopentyl]amino]-3-pyridinyl]-pyrrolidin-1-ylmethanone?
The canonical SMILES for [2-[[(1R,2R)-2-hydroxy-4-(pyrazol-1-ylmethyl)cyclopentyl]amino]-3-pyridinyl]-pyrrolidin-1-ylmethanone is O=C(c1cccnc1N[C@@H]1CC(Cn2cccn2)C[C@H]1O)N1CCCC1.
What is the InChIKey of [2-[[(1R,2R)-2-hydroxy-4-(pyrazol-1-ylmethyl)cyclopentyl]amino]-3-pyridinyl]-pyrrolidin-1-ylmethanone?
The InChIKey is GLBCYUPTMGFOSY-VNCLPFQGSA-N. The full InChI is InChI=1S/C19H25N5O2/c25-17-12-14(13-24-10-4-7-21-24)11-16(17)22-18-15(5-3-6-20-18)19(26)23-8-1-2-9-23/h3-7,10,14,16-17,25H,1-2,8-9,11-13H2,(H,20,22)/t14?,16-,17-/m1/s1.
What are the key properties of [2-[[(1R,2R)-2-hydroxy-4-(pyrazol-1-ylmethyl)cyclopentyl]amino]-3-pyridinyl]-pyrrolidin-1-ylmethanone?
[2-[[(1R,2R)-2-hydroxy-4-(pyrazol-1-ylmethyl)cyclopentyl]amino]-3-pyridinyl]-pyrrolidin-1-ylmethanone has a molecular weight of 355.44 g/mol, XLogP of 1.77, 5 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for [2-[[(1R,2R)-2-hydroxy-4-(pyrazol-1-ylmethyl)cyclopentyl]amino]-3-pyridinyl]-pyrrolidin-1-ylmethanone is sourced from PubChem (CID 154798355), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).