[(3R)-3-(aminomethyl)piperidin-1-yl]-(1H-imidazol-5-yl)methanone

C10H16N4O — CID 129371649

IUPAC[(3R)-3-(aminomethyl)piperidin-1-yl]-(1H-imidazol-5-yl)methanone
SMILESNC[C@H]1CCCN(C(=O)c2cnc[nH]2)C1
InChIInChI=1S/C10H16N4O/c11-4-8-2-1-3-14(6-8)10(15)9-5-12-7-13-9/h5,7-8H,1-4,6,11H2,(H,12,13)/t8-/m1/s1
InChIKeyFDLDQYQHDXNPHX-MRVPVSSYSA-N
MW208.26 g/mol
LogP0.22
Rot. Bonds2

About [(3R)-3-(aminomethyl)piperidin-1-yl]-(1H-imidazol-5-yl)methanone

[(3R)-3-(aminomethyl)piperidin-1-yl]-(1H-imidazol-5-yl)methanone (PubChem CID 129371649) has the molecular formula C10H16N4O and a molecular weight of 208.26 g/mol. Its IUPAC name is [(3R)-3-(aminomethyl)piperidin-1-yl]-(1H-imidazol-5-yl)methanone.

Molecular Properties

Compound Name[(3R)-3-(aminomethyl)piperidin-1-yl]-(1H-imidazol-5-yl)methanone
PubChem CID129371649
Molecular FormulaC10H16N4O
Molecular Weight208.26 g/mol
Exact Mass208.13
IUPAC Name[(3R)-3-(aminomethyl)piperidin-1-yl]-(1H-imidazol-5-yl)methanone
SMILESNC[C@H]1CCCN(C(=O)c2cnc[nH]2)C1
InChIInChI=1S/C10H16N4O/c11-4-8-2-1-3-14(6-8)10(15)9-5-12-7-13-9/h5,7-8H,1-4,6,11H2,(H,12,13)/t8-/m1/s1
InChIKeyFDLDQYQHDXNPHX-MRVPVSSYSA-N
XLogP0.22
TPSA75.01 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.26
LogP ≤ 50.22
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze [(3R)-3-(aminomethyl)piperidin-1-yl]-(1H-imidazol-5-yl)methanone with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

1H-imidazol-5-yl-[(3R)-3-(methylsulfanylmethyl)piperidin-1-yl]methanone
CID 125144377
1H-imidazol-5-yl-[(3S)-3-(methylsulfanylmethyl)piperidin-1-yl]methanone
CID 125144378
1H-imidazol-5-yl-[(3R)-3-methylpyrrolidin-1-yl]methanone
CID 89293635
1-(1H-imidazole-5-carbonyl)piperidine-3,4-dicarboxylic acid
CID 112568032
[3-(aminomethyl)piperidin-1-yl]-(3-methylimidazol-4-yl)methanone
CID 103510238
ethane;1H-imidazol-5-yl(piperidin-1-yl)methanone
CID 142344786
[3-(aminomethyl)piperidin-1-yl]-(3-chloro-4-pyridinyl)methanone
CID 66484755
[(3R)-1-(1H-imidazole-5-carbonyl)piperidin-3-yl]-(4-phenylphenyl)methanone
CID 42454203
[3-(aminomethyl)piperidin-1-yl]-(5-bromo-2-pyridinyl)methanone
CID 62959741
3-[3-(aminomethyl)piperidine-1-carbonyl]-1H-pyridazin-6-one
CID 103805953
[3-(aminomethyl)pyrrolidin-1-yl]-(2H-triazol-4-yl)methanone
CID 63282840
1H-imidazol-5-yl-[3-(trifluoromethoxymethyl)azetidin-1-yl]methanone
CID 163279465

Frequently Asked Questions

What is the IUPAC name of [(3R)-3-(aminomethyl)piperidin-1-yl]-(1H-imidazol-5-yl)methanone?
The IUPAC name of [(3R)-3-(aminomethyl)piperidin-1-yl]-(1H-imidazol-5-yl)methanone (CID 129371649) is [(3R)-3-(aminomethyl)piperidin-1-yl]-(1H-imidazol-5-yl)methanone.
What is the SMILES notation for [(3R)-3-(aminomethyl)piperidin-1-yl]-(1H-imidazol-5-yl)methanone?
The canonical SMILES for [(3R)-3-(aminomethyl)piperidin-1-yl]-(1H-imidazol-5-yl)methanone is NC[C@H]1CCCN(C(=O)c2cnc[nH]2)C1.
What is the InChIKey of [(3R)-3-(aminomethyl)piperidin-1-yl]-(1H-imidazol-5-yl)methanone?
The InChIKey is FDLDQYQHDXNPHX-MRVPVSSYSA-N. The full InChI is InChI=1S/C10H16N4O/c11-4-8-2-1-3-14(6-8)10(15)9-5-12-7-13-9/h5,7-8H,1-4,6,11H2,(H,12,13)/t8-/m1/s1.
What are the key properties of [(3R)-3-(aminomethyl)piperidin-1-yl]-(1H-imidazol-5-yl)methanone?
[(3R)-3-(aminomethyl)piperidin-1-yl]-(1H-imidazol-5-yl)methanone has a molecular weight of 208.26 g/mol, XLogP of 0.22, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [(3R)-3-(aminomethyl)piperidin-1-yl]-(1H-imidazol-5-yl)methanone is sourced from PubChem (CID 129371649), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).