N-cyclopropyl-2-[4-(pyrimidin-5-ylmethylamino)pyrazol-1-yl]acetamide

C13H16N6O — CID 62760299

IUPACN-cyclopropyl-2-[4-(pyrimidin-5-ylmethylamino)pyrazol-1-yl]acetamide
SMILESO=C(Cn1cc(NCc2cncnc2)cn1)NC1CC1
InChIInChI=1S/C13H16N6O/c20-13(18-11-1-2-11)8-19-7-12(6-17-19)16-5-10-3-14-9-15-4-10/h3-4,6-7,9,11,16H,1-2,5,8H2,(H,18,20)
InChIKeySDYJLRSAMXGOCD-UHFFFAOYSA-N
MW272.31 g/mol
LogP0.56
Rot. Bonds6

About N-cyclopropyl-2-[4-(pyrimidin-5-ylmethylamino)pyrazol-1-yl]acetamide

N-cyclopropyl-2-[4-(pyrimidin-5-ylmethylamino)pyrazol-1-yl]acetamide (PubChem CID 62760299) has the molecular formula C13H16N6O and a molecular weight of 272.31 g/mol. Its IUPAC name is N-cyclopropyl-2-[4-(pyrimidin-5-ylmethylamino)pyrazol-1-yl]acetamide.

Molecular Properties

Compound NameN-cyclopropyl-2-[4-(pyrimidin-5-ylmethylamino)pyrazol-1-yl]acetamide
PubChem CID62760299
Molecular FormulaC13H16N6O
Molecular Weight272.31 g/mol
Exact Mass272.14
IUPAC NameN-cyclopropyl-2-[4-(pyrimidin-5-ylmethylamino)pyrazol-1-yl]acetamide
SMILESO=C(Cn1cc(NCc2cncnc2)cn1)NC1CC1
InChIInChI=1S/C13H16N6O/c20-13(18-11-1-2-11)8-19-7-12(6-17-19)16-5-10-3-14-9-15-4-10/h3-4,6-7,9,11,16H,1-2,5,8H2,(H,18,20)
InChIKeySDYJLRSAMXGOCD-UHFFFAOYSA-N
XLogP0.56
TPSA84.73 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.31
LogP ≤ 50.56
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

N-methyl-2-[4-(pyrimidin-5-ylmethylamino)pyrazol-1-yl]acetamide
CID 62760481
N-cyclopropyl-2-[4-[(3-hydroxyphenyl)methylamino]pyrazol-1-yl]acetamide
CID 60931820
2-[4-(cyclopentylmethylamino)pyrazol-1-yl]-N-cyclopropylacetamide
CID 62069655
2-[4-[(2-aminophenyl)methylamino]pyrazol-1-yl]-N-cyclopropylacetamide
CID 66419223
N-cyclopropyl-2-[4-[(1-methylpyrrol-2-yl)methylamino]pyrazol-1-yl]acetamide
CID 62131163
N-cyclopropyl-2-[4-[(2-ethylpyrazol-3-yl)methylamino]pyrazol-1-yl]acetamide
CID 115762221
N-cyclopropyl-2-[4-(propan-2-ylamino)pyrazol-1-yl]acetamide
CID 60931819
N-cyclopropyl-2-[4-(oxolan-2-ylmethylamino)pyrazol-1-yl]acetamide
CID 82836260
N-cyclopropyl-2-[4-(propylsulfonylamino)pyrazol-1-yl]acetamide
CID 61061294
4-chloro-N-[1-[2-(cyclopropylamino)-2-oxoethyl]pyrazol-4-yl]butanamide
CID 63307715
2-amino-N-[1-[2-(cyclopropylamino)-2-oxoethyl]pyrazol-4-yl]cyclopropane-1-carboxamide
CID 55035959
2-[4-[(4-cyclopropylphenyl)methylamino]pyrazol-1-yl]-N-methylacetamide
CID 79968644

Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-2-[4-(pyrimidin-5-ylmethylamino)pyrazol-1-yl]acetamide?
The IUPAC name of N-cyclopropyl-2-[4-(pyrimidin-5-ylmethylamino)pyrazol-1-yl]acetamide (CID 62760299) is N-cyclopropyl-2-[4-(pyrimidin-5-ylmethylamino)pyrazol-1-yl]acetamide.
What is the SMILES notation for N-cyclopropyl-2-[4-(pyrimidin-5-ylmethylamino)pyrazol-1-yl]acetamide?
The canonical SMILES for N-cyclopropyl-2-[4-(pyrimidin-5-ylmethylamino)pyrazol-1-yl]acetamide is O=C(Cn1cc(NCc2cncnc2)cn1)NC1CC1.
What is the InChIKey of N-cyclopropyl-2-[4-(pyrimidin-5-ylmethylamino)pyrazol-1-yl]acetamide?
The InChIKey is SDYJLRSAMXGOCD-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H16N6O/c20-13(18-11-1-2-11)8-19-7-12(6-17-19)16-5-10-3-14-9-15-4-10/h3-4,6-7,9,11,16H,1-2,5,8H2,(H,18,20).
What are the key properties of N-cyclopropyl-2-[4-(pyrimidin-5-ylmethylamino)pyrazol-1-yl]acetamide?
N-cyclopropyl-2-[4-(pyrimidin-5-ylmethylamino)pyrazol-1-yl]acetamide has a molecular weight of 272.31 g/mol, XLogP of 0.56, 6 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-2-[4-(pyrimidin-5-ylmethylamino)pyrazol-1-yl]acetamide is sourced from PubChem (CID 62760299), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).