(2-amino-6-propan-2-yl-4-pyridinyl)-[3-(2-hydroxyethyl)pyrrolidin-1-yl]methanone

C15H23N3O2 — CID 114799910

IUPAC(2-amino-6-propan-2-yl-4-pyridinyl)-[3-(2-hydroxyethyl)pyrrolidin-1-yl]methanone
SMILESCC(C)c1cc(C(=O)N2CCC(CCO)C2)cc(N)n1
InChIInChI=1S/C15H23N3O2/c1-10(2)13-7-12(8-14(16)17-13)15(20)18-5-3-11(9-18)4-6-19/h7-8,10-11,19H,3-6,9H2,1-2H3,(H2,16,17)
InChIKeyWZQZKAAFUFFXCH-UHFFFAOYSA-N
MW277.37 g/mol
LogP1.63
Rot. Bonds4

About (2-amino-6-propan-2-yl-4-pyridinyl)-[3-(2-hydroxyethyl)pyrrolidin-1-yl]methanone

(2-amino-6-propan-2-yl-4-pyridinyl)-[3-(2-hydroxyethyl)pyrrolidin-1-yl]methanone (PubChem CID 114799910) has the molecular formula C15H23N3O2 and a molecular weight of 277.37 g/mol. Its IUPAC name is (2-amino-6-propan-2-yl-4-pyridinyl)-[3-(2-hydroxyethyl)pyrrolidin-1-yl]methanone.

Molecular Properties

Compound Name(2-amino-6-propan-2-yl-4-pyridinyl)-[3-(2-hydroxyethyl)pyrrolidin-1-yl]methanone
PubChem CID114799910
Molecular FormulaC15H23N3O2
Molecular Weight277.37 g/mol
Exact Mass277.18
IUPAC Name(2-amino-6-propan-2-yl-4-pyridinyl)-[3-(2-hydroxyethyl)pyrrolidin-1-yl]methanone
SMILESCC(C)c1cc(C(=O)N2CCC(CCO)C2)cc(N)n1
InChIInChI=1S/C15H23N3O2/c1-10(2)13-7-12(8-14(16)17-13)15(20)18-5-3-11(9-18)4-6-19/h7-8,10-11,19H,3-6,9H2,1-2H3,(H2,16,17)
InChIKeyWZQZKAAFUFFXCH-UHFFFAOYSA-N
XLogP1.63
TPSA79.45 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.37
LogP ≤ 51.63
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

(4-amino-3,5-dichlorophenyl)-[3-(2-hydroxyethyl)pyrrolidin-1-yl]methanone
CID 115869589
(2-hydrazinyl-6-methyl-4-pyridinyl)-[3-(2-hydroxyethyl)pyrrolidin-1-yl]methanone
CID 114799971
[2-ethyl-6-(ethylamino)-4-pyridinyl]-[3-(2-hydroxyethyl)pyrrolidin-1-yl]methanone
CID 114799911
(2-amino-4-pyridinyl)-[3-(2-hydroxyethyl)piperidin-1-yl]methanone
CID 107228705
(4-amino-3-chlorophenyl)-[3-(2-hydroxyethyl)pyrrolidin-1-yl]methanone
CID 114796674
(3-amino-4-fluorophenyl)-[3-(2-hydroxyethyl)pyrrolidin-1-yl]methanone
CID 114796726
(3-ethylpyrrolidin-1-yl)-(2-propan-2-yl-4-pyridinyl)methanone
CID 167547190
(4-amino-3-methoxyphenyl)-[3-(2-hydroxyethyl)pyrrolidin-1-yl]methanone
CID 114796729
[3-(2-hydroxyethyl)pyrrolidin-1-yl]-(5-iodothiophen-3-yl)methanone
CID 115746358
6-hydroxy-4-[3-(2-hydroxyethyl)pyrrolidine-1-carbonyl]-1H-pyridin-2-one
CID 114799248
(4-amino-5-methylthiophen-2-yl)-[3-(2-hydroxyethyl)pyrrolidin-1-yl]methanone
CID 114796719
[(3S)-1-(2-amino-6-propan-2-ylpyrimidine-4-carbonyl)pyrrolidin-3-yl]methanesulfonamide
CID 125168841

Frequently Asked Questions

What is the IUPAC name of (2-amino-6-propan-2-yl-4-pyridinyl)-[3-(2-hydroxyethyl)pyrrolidin-1-yl]methanone?
The IUPAC name of (2-amino-6-propan-2-yl-4-pyridinyl)-[3-(2-hydroxyethyl)pyrrolidin-1-yl]methanone (CID 114799910) is (2-amino-6-propan-2-yl-4-pyridinyl)-[3-(2-hydroxyethyl)pyrrolidin-1-yl]methanone.
What is the SMILES notation for (2-amino-6-propan-2-yl-4-pyridinyl)-[3-(2-hydroxyethyl)pyrrolidin-1-yl]methanone?
The canonical SMILES for (2-amino-6-propan-2-yl-4-pyridinyl)-[3-(2-hydroxyethyl)pyrrolidin-1-yl]methanone is CC(C)c1cc(C(=O)N2CCC(CCO)C2)cc(N)n1.
What is the InChIKey of (2-amino-6-propan-2-yl-4-pyridinyl)-[3-(2-hydroxyethyl)pyrrolidin-1-yl]methanone?
The InChIKey is WZQZKAAFUFFXCH-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23N3O2/c1-10(2)13-7-12(8-14(16)17-13)15(20)18-5-3-11(9-18)4-6-19/h7-8,10-11,19H,3-6,9H2,1-2H3,(H2,16,17).
What are the key properties of (2-amino-6-propan-2-yl-4-pyridinyl)-[3-(2-hydroxyethyl)pyrrolidin-1-yl]methanone?
(2-amino-6-propan-2-yl-4-pyridinyl)-[3-(2-hydroxyethyl)pyrrolidin-1-yl]methanone has a molecular weight of 277.37 g/mol, XLogP of 1.63, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2-amino-6-propan-2-yl-4-pyridinyl)-[3-(2-hydroxyethyl)pyrrolidin-1-yl]methanone is sourced from PubChem (CID 114799910), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).