2-[1-[(2-amino-3-pyridinyl)methyl]-3-hydroxypiperidin-3-yl]-N,N-dimethylacetamide

C15H24N4O2 — CID 167822220

IUPAC2-[1-[(2-amino-3-pyridinyl)methyl]-3-hydroxypiperidin-3-yl]-N,N-dimethylacetamide
SMILESCN(C)C(=O)CC1(O)CCCN(Cc2cccnc2N)C1
InChIInChI=1S/C15H24N4O2/c1-18(2)13(20)9-15(21)6-4-8-19(11-15)10-12-5-3-7-17-14(12)16/h3,5,7,21H,4,6,8-11H2,1-2H3,(H2,16,17)
InChIKeyZOKSPYHETTUMRS-UHFFFAOYSA-N
MW292.38 g/mol
LogP0.47
Rot. Bonds4

About 2-[1-[(2-amino-3-pyridinyl)methyl]-3-hydroxypiperidin-3-yl]-N,N-dimethylacetamide

2-[1-[(2-amino-3-pyridinyl)methyl]-3-hydroxypiperidin-3-yl]-N,N-dimethylacetamide (PubChem CID 167822220) has the molecular formula C15H24N4O2 and a molecular weight of 292.38 g/mol. Its IUPAC name is 2-[1-[(2-amino-3-pyridinyl)methyl]-3-hydroxypiperidin-3-yl]-N,N-dimethylacetamide.

Molecular Properties

Compound Name2-[1-[(2-amino-3-pyridinyl)methyl]-3-hydroxypiperidin-3-yl]-N,N-dimethylacetamide
PubChem CID167822220
Molecular FormulaC15H24N4O2
Molecular Weight292.38 g/mol
Exact Mass292.19
IUPAC Name2-[1-[(2-amino-3-pyridinyl)methyl]-3-hydroxypiperidin-3-yl]-N,N-dimethylacetamide
SMILESCN(C)C(=O)CC1(O)CCCN(Cc2cccnc2N)C1
InChIInChI=1S/C15H24N4O2/c1-18(2)13(20)9-15(21)6-4-8-19(11-15)10-12-5-3-7-17-14(12)16/h3,5,7,21H,4,6,8-11H2,1-2H3,(H2,16,17)
InChIKeyZOKSPYHETTUMRS-UHFFFAOYSA-N
XLogP0.47
TPSA82.69 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.38
LogP ≤ 50.47
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

(3R)-3-[(dimethylamino)methyl]-1-(quinolin-5-ylmethyl)piperidin-3-ol
CID 95897724
(3R)-1-[(2-amino-3-pyridinyl)methyl]-3-(2-methoxyethyl)piperidine-3-carboxylic acid
CID 97122214
3-(pyrrolidin-1-ylmethyl)pyridin-2-amine
CID 62470567
(3R)-1-[(2-amino-3-pyridinyl)methyl]-3-(cyclopropylmethyl)piperidine-3-carboxylic acid
CID 97119136
1-[4-[(2-amino-3-pyridinyl)methyl]-1,4-diazepan-1-yl]ethanone
CID 62466270
3-(piperidin-1-ylmethyl)pyridin-2-amine
CID 18771814
2-[[3-[(dimethylamino)methyl]-3-hydroxypiperidin-1-yl]methyl]benzoic acid
CID 77081860
3-[[(3R)-3-(1,3-benzodioxol-5-ylmethyl)-3-methylpiperidin-1-yl]methyl]pyridin-2-amine
CID 97270188
(3S)-3-hydroxy-1-[(2-methoxy-3-pyridinyl)methyl]piperidine-3-carboxamide
CID 100649159
1-[(2-amino-3-pyridinyl)methyl]cyclobutan-1-ol
CID 79081595
(5S)-2-[(2-amino-3-pyridinyl)methyl]-7-(cyclopropylmethyl)-2,7-diazaspiro[4.5]decan-6-one
CID 97141834
1-[(2-amino-3-pyridinyl)methyl]-4-(5-methyl-2-pyridinyl)piperidin-4-ol
CID 56742663

Frequently Asked Questions

What is the IUPAC name of 2-[1-[(2-amino-3-pyridinyl)methyl]-3-hydroxypiperidin-3-yl]-N,N-dimethylacetamide?
The IUPAC name of 2-[1-[(2-amino-3-pyridinyl)methyl]-3-hydroxypiperidin-3-yl]-N,N-dimethylacetamide (CID 167822220) is 2-[1-[(2-amino-3-pyridinyl)methyl]-3-hydroxypiperidin-3-yl]-N,N-dimethylacetamide.
What is the SMILES notation for 2-[1-[(2-amino-3-pyridinyl)methyl]-3-hydroxypiperidin-3-yl]-N,N-dimethylacetamide?
The canonical SMILES for 2-[1-[(2-amino-3-pyridinyl)methyl]-3-hydroxypiperidin-3-yl]-N,N-dimethylacetamide is CN(C)C(=O)CC1(O)CCCN(Cc2cccnc2N)C1.
What is the InChIKey of 2-[1-[(2-amino-3-pyridinyl)methyl]-3-hydroxypiperidin-3-yl]-N,N-dimethylacetamide?
The InChIKey is ZOKSPYHETTUMRS-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N4O2/c1-18(2)13(20)9-15(21)6-4-8-19(11-15)10-12-5-3-7-17-14(12)16/h3,5,7,21H,4,6,8-11H2,1-2H3,(H2,16,17).
What are the key properties of 2-[1-[(2-amino-3-pyridinyl)methyl]-3-hydroxypiperidin-3-yl]-N,N-dimethylacetamide?
2-[1-[(2-amino-3-pyridinyl)methyl]-3-hydroxypiperidin-3-yl]-N,N-dimethylacetamide has a molecular weight of 292.38 g/mol, XLogP of 0.47, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[1-[(2-amino-3-pyridinyl)methyl]-3-hydroxypiperidin-3-yl]-N,N-dimethylacetamide is sourced from PubChem (CID 167822220), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).