N,6-dimethyl-N-[(1-methylpyrrolidin-2-yl)methyl]piperidine-3-carboxamide

C14H27N3O — CID 79319499

IUPACN,6-dimethyl-N-[(1-methylpyrrolidin-2-yl)methyl]piperidine-3-carboxamide
SMILESCC1CCC(C(=O)N(C)CC2CCCN2C)CN1
InChIInChI=1S/C14H27N3O/c1-11-6-7-12(9-15-11)14(18)17(3)10-13-5-4-8-16(13)2/h11-13,15H,4-10H2,1-3H3
InChIKeyYQYNNEDUMTWARB-UHFFFAOYSA-N
MW253.39 g/mol
LogP0.93
Rot. Bonds3

About N,6-dimethyl-N-[(1-methylpyrrolidin-2-yl)methyl]piperidine-3-carboxamide

N,6-dimethyl-N-[(1-methylpyrrolidin-2-yl)methyl]piperidine-3-carboxamide (PubChem CID 79319499) has the molecular formula C14H27N3O and a molecular weight of 253.39 g/mol. Its IUPAC name is N,6-dimethyl-N-[(1-methylpyrrolidin-2-yl)methyl]piperidine-3-carboxamide.

Molecular Properties

Compound NameN,6-dimethyl-N-[(1-methylpyrrolidin-2-yl)methyl]piperidine-3-carboxamide
PubChem CID79319499
Molecular FormulaC14H27N3O
Molecular Weight253.39 g/mol
Exact Mass253.22
IUPAC NameN,6-dimethyl-N-[(1-methylpyrrolidin-2-yl)methyl]piperidine-3-carboxamide
SMILESCC1CCC(C(=O)N(C)CC2CCCN2C)CN1
InChIInChI=1S/C14H27N3O/c1-11-6-7-12(9-15-11)14(18)17(3)10-13-5-4-8-16(13)2/h11-13,15H,4-10H2,1-3H3
InChIKeyYQYNNEDUMTWARB-UHFFFAOYSA-N
XLogP0.93
TPSA35.58 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500253.39
LogP ≤ 50.93
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-methyl-N-[(1-methylpyrrolidin-2-yl)methyl]azepane-2-carboxamide
CID 79314390
6-methyl-N-[(1-methylpyrrolidin-2-yl)methyl]piperidine-3-carboxamide
CID 106026312
2-[methyl-[(1-methylpyrrolidin-2-yl)methyl]amino]-2-oxoacetic acid
CID 79315922
N,6-dimethyl-N-(2-methylpropyl)piperidine-3-carboxamide
CID 43272321
N,N,6-trimethylpiperidine-3-carboxamide
CID 24697957
N-[(1-hydroxycyclopentyl)methyl]-N,6-dimethylpiperidine-3-carboxamide
CID 114949603
N,2-dimethyl-N-[(1-methylpyrrolidin-2-yl)methyl]propanamide
CID 79312888
N-methyl-N-[(1-methylpyrrolidin-2-yl)methyl]piperazine-1-carboxamide
CID 79314035
2-amino-N-methyl-N-[[(2S)-1-methylpyrrolidin-2-yl]methyl]propanamide
CID 121226107
1-methyl-1-[(1-methylpyrrolidin-2-yl)methyl]-3-propan-2-ylurea
CID 116656611
N-methyl-N-[(1-methylpyrrolidin-2-yl)methyl]-2-morpholin-2-ylacetamide
CID 79314743
1-amino-N-methyl-N-[(1-methylpyrrolidin-2-yl)methyl]cyclopropane-1-carboxamide
CID 79314821

Frequently Asked Questions

What is the IUPAC name of N,6-dimethyl-N-[(1-methylpyrrolidin-2-yl)methyl]piperidine-3-carboxamide?
The IUPAC name of N,6-dimethyl-N-[(1-methylpyrrolidin-2-yl)methyl]piperidine-3-carboxamide (CID 79319499) is N,6-dimethyl-N-[(1-methylpyrrolidin-2-yl)methyl]piperidine-3-carboxamide.
What is the SMILES notation for N,6-dimethyl-N-[(1-methylpyrrolidin-2-yl)methyl]piperidine-3-carboxamide?
The canonical SMILES for N,6-dimethyl-N-[(1-methylpyrrolidin-2-yl)methyl]piperidine-3-carboxamide is CC1CCC(C(=O)N(C)CC2CCCN2C)CN1.
What is the InChIKey of N,6-dimethyl-N-[(1-methylpyrrolidin-2-yl)methyl]piperidine-3-carboxamide?
The InChIKey is YQYNNEDUMTWARB-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H27N3O/c1-11-6-7-12(9-15-11)14(18)17(3)10-13-5-4-8-16(13)2/h11-13,15H,4-10H2,1-3H3.
What are the key properties of N,6-dimethyl-N-[(1-methylpyrrolidin-2-yl)methyl]piperidine-3-carboxamide?
N,6-dimethyl-N-[(1-methylpyrrolidin-2-yl)methyl]piperidine-3-carboxamide has a molecular weight of 253.39 g/mol, XLogP of 0.93, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N,6-dimethyl-N-[(1-methylpyrrolidin-2-yl)methyl]piperidine-3-carboxamide is sourced from PubChem (CID 79319499), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).