N,N-dimethyl-4-[methyl(pyrrolidin-2-ylmethyl)amino]piperidine-1-carboxamide

C14H28N4O — CID 106602681

IUPACN,N-dimethyl-4-[methyl(pyrrolidin-2-ylmethyl)amino]piperidine-1-carboxamide
SMILESCN(C)C(=O)N1CCC(N(C)CC2CCCN2)CC1
InChIInChI=1S/C14H28N4O/c1-16(2)14(19)18-9-6-13(7-10-18)17(3)11-12-5-4-8-15-12/h12-13,15H,4-11H2,1-3H3
InChIKeyBEIPLVLIQUILKA-UHFFFAOYSA-N
MW268.40 g/mol
LogP0.82
Rot. Bonds3

About N,N-dimethyl-4-[methyl(pyrrolidin-2-ylmethyl)amino]piperidine-1-carboxamide

N,N-dimethyl-4-[methyl(pyrrolidin-2-ylmethyl)amino]piperidine-1-carboxamide (PubChem CID 106602681) has the molecular formula C14H28N4O and a molecular weight of 268.40 g/mol. Its IUPAC name is N,N-dimethyl-4-[methyl(pyrrolidin-2-ylmethyl)amino]piperidine-1-carboxamide.

Molecular Properties

Compound NameN,N-dimethyl-4-[methyl(pyrrolidin-2-ylmethyl)amino]piperidine-1-carboxamide
PubChem CID106602681
Molecular FormulaC14H28N4O
Molecular Weight268.40 g/mol
Exact Mass268.23
IUPAC NameN,N-dimethyl-4-[methyl(pyrrolidin-2-ylmethyl)amino]piperidine-1-carboxamide
SMILESCN(C)C(=O)N1CCC(N(C)CC2CCCN2)CC1
InChIInChI=1S/C14H28N4O/c1-16(2)14(19)18-9-6-13(7-10-18)17(3)11-12-5-4-8-15-12/h12-13,15H,4-11H2,1-3H3
InChIKeyBEIPLVLIQUILKA-UHFFFAOYSA-N
XLogP0.82
TPSA38.82 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.40
LogP ≤ 50.82
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N,N-dimethyl-4-(3-piperidin-2-ylpropanoyl)piperazine-1-carboxamide
CID 62211785
4-tert-butyl-N-methyl-N-(pyrrolidin-2-ylmethyl)cyclohexan-1-amine
CID 106602645
N-methyl-N-[[(2S)-pyrrolidin-2-yl]methyl]pyrrolidin-3-amine
CID 131134698
N,3,3-trimethyl-N-(pyrrolidin-2-ylmethyl)cyclopentan-1-amine
CID 106602628
4-(dimethylamino)-N,N-dimethylpiperidine-1-carboxamide
CID 110470375
propan-2-yl N-cyclopropyl-N-(pyrrolidin-2-ylmethyl)carbamate
CID 106599450
4-methyl-N-(piperidin-2-ylmethyl)-N-propylpiperidine-1-carboxamide
CID 106629827
N-methyl-N-[[(2S)-pyrrolidin-2-yl]methyl]oxolan-3-amine
CID 104870205
N-methyl-N-(pyrrolidin-2-ylmethyl)oxolan-3-amine
CID 82739396
N,N-dimethyl-2-[(2R)-pyrrolidin-2-yl]acetamide
CID 66777504
2-[methyl(piperidin-2-ylmethyl)amino]-1-piperidin-1-ylpropan-1-one
CID 106635350
3-ethyl-N-methyl-N-(pyrrolidin-2-ylmethyl)cyclohexan-1-amine
CID 106602502

Frequently Asked Questions

What is the IUPAC name of N,N-dimethyl-4-[methyl(pyrrolidin-2-ylmethyl)amino]piperidine-1-carboxamide?
The IUPAC name of N,N-dimethyl-4-[methyl(pyrrolidin-2-ylmethyl)amino]piperidine-1-carboxamide (CID 106602681) is N,N-dimethyl-4-[methyl(pyrrolidin-2-ylmethyl)amino]piperidine-1-carboxamide.
What is the SMILES notation for N,N-dimethyl-4-[methyl(pyrrolidin-2-ylmethyl)amino]piperidine-1-carboxamide?
The canonical SMILES for N,N-dimethyl-4-[methyl(pyrrolidin-2-ylmethyl)amino]piperidine-1-carboxamide is CN(C)C(=O)N1CCC(N(C)CC2CCCN2)CC1.
What is the InChIKey of N,N-dimethyl-4-[methyl(pyrrolidin-2-ylmethyl)amino]piperidine-1-carboxamide?
The InChIKey is BEIPLVLIQUILKA-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H28N4O/c1-16(2)14(19)18-9-6-13(7-10-18)17(3)11-12-5-4-8-15-12/h12-13,15H,4-11H2,1-3H3.
What are the key properties of N,N-dimethyl-4-[methyl(pyrrolidin-2-ylmethyl)amino]piperidine-1-carboxamide?
N,N-dimethyl-4-[methyl(pyrrolidin-2-ylmethyl)amino]piperidine-1-carboxamide has a molecular weight of 268.40 g/mol, XLogP of 0.82, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethyl-4-[methyl(pyrrolidin-2-ylmethyl)amino]piperidine-1-carboxamide is sourced from PubChem (CID 106602681), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).