1-(3-amino-2-hydroxypropyl)-6-methylpiperidine-3-carboxamide

C10H21N3O2 — CID 104643418

IUPAC1-(3-amino-2-hydroxypropyl)-6-methylpiperidine-3-carboxamide
SMILESCC1CCC(C(N)=O)CN1CC(O)CN
InChIInChI=1S/C10H21N3O2/c1-7-2-3-8(10(12)15)5-13(7)6-9(14)4-11/h7-9,14H,2-6,11H2,1H3,(H2,12,15)
InChIKeyMMHFUCFRZNLJAK-UHFFFAOYSA-N
MW215.30 g/mol
LogP-1.11
Rot. Bonds4

About 1-(3-amino-2-hydroxypropyl)-6-methylpiperidine-3-carboxamide

1-(3-amino-2-hydroxypropyl)-6-methylpiperidine-3-carboxamide (PubChem CID 104643418) has the molecular formula C10H21N3O2 and a molecular weight of 215.30 g/mol. Its IUPAC name is 1-(3-amino-2-hydroxypropyl)-6-methylpiperidine-3-carboxamide.

Molecular Properties

Compound Name1-(3-amino-2-hydroxypropyl)-6-methylpiperidine-3-carboxamide
PubChem CID104643418
Molecular FormulaC10H21N3O2
Molecular Weight215.30 g/mol
Exact Mass215.16
IUPAC Name1-(3-amino-2-hydroxypropyl)-6-methylpiperidine-3-carboxamide
SMILESCC1CCC(C(N)=O)CN1CC(O)CN
InChIInChI=1S/C10H21N3O2/c1-7-2-3-8(10(12)15)5-13(7)6-9(14)4-11/h7-9,14H,2-6,11H2,1H3,(H2,12,15)
InChIKeyMMHFUCFRZNLJAK-UHFFFAOYSA-N
XLogP-1.11
TPSA92.58 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500215.30
LogP ≤ 5-1.11
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

1-(2,3-dihydroxypropyl)-6-methylpiperidine-3-carboxamide
CID 82849638
1-(2-bromo-3,3,3-trifluoropropyl)-6-methylpiperidine-3-carboxamide
CID 64758750
(3R,6S)-6-methyl-1-(3-methylbut-2-enyl)piperidine-3-carboxamide
CID 95292502
1-[3-(2-chloro-5-methylphenoxy)-2-hydroxypropyl]-6-methylpiperidine-3-carboxamide
CID 75504369
6-methyl-1-pent-4-ynylpiperidine-3-carboxamide
CID 115873029
1-amino-3-(2-methylpyrrolidin-1-yl)propan-2-ol;2-methylpropane
CID 143050174
6-methyl-1-(pyrrolidin-3-ylmethyl)piperidine-3-carboxamide
CID 62370528
6-methyl-1-[[(2S)-pyrrolidin-2-yl]methyl]piperidine-3-carboxamide
CID 104870094
1-(4-hydrazinyl-4-oxobutyl)-6-methylpiperidine-3-carboxamide
CID 63585802
1-[(4-hydroxypiperidin-4-yl)methyl]-6-methylpiperidine-3-carboxamide
CID 62222385
1-(3-aminopropanoyl)-6-methylpiperidine-3-carboxamide;hydrochloride
CID 119291566
acetaldehyde;1,6-dimethylpiperidine-3-carboxamide
CID 156717131

Frequently Asked Questions

What is the IUPAC name of 1-(3-amino-2-hydroxypropyl)-6-methylpiperidine-3-carboxamide?
The IUPAC name of 1-(3-amino-2-hydroxypropyl)-6-methylpiperidine-3-carboxamide (CID 104643418) is 1-(3-amino-2-hydroxypropyl)-6-methylpiperidine-3-carboxamide.
What is the SMILES notation for 1-(3-amino-2-hydroxypropyl)-6-methylpiperidine-3-carboxamide?
The canonical SMILES for 1-(3-amino-2-hydroxypropyl)-6-methylpiperidine-3-carboxamide is CC1CCC(C(N)=O)CN1CC(O)CN.
What is the InChIKey of 1-(3-amino-2-hydroxypropyl)-6-methylpiperidine-3-carboxamide?
The InChIKey is MMHFUCFRZNLJAK-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H21N3O2/c1-7-2-3-8(10(12)15)5-13(7)6-9(14)4-11/h7-9,14H,2-6,11H2,1H3,(H2,12,15).
What are the key properties of 1-(3-amino-2-hydroxypropyl)-6-methylpiperidine-3-carboxamide?
1-(3-amino-2-hydroxypropyl)-6-methylpiperidine-3-carboxamide has a molecular weight of 215.30 g/mol, XLogP of -1.11, 4 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3-amino-2-hydroxypropyl)-6-methylpiperidine-3-carboxamide is sourced from PubChem (CID 104643418), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).