4-[(dimethylamino)methyl]-N-methylpiperidine-1-carboxamide

C10H21N3O — CID 115583877

IUPAC4-[(dimethylamino)methyl]-N-methylpiperidine-1-carboxamide
SMILESCNC(=O)N1CCC(CN(C)C)CC1
InChIInChI=1S/C10H21N3O/c1-11-10(14)13-6-4-9(5-7-13)8-12(2)3/h9H,4-8H2,1-3H3,(H,11,14)
InChIKeyQRMQGQGCTBKQPV-UHFFFAOYSA-N
MW199.30 g/mol
LogP0.60
Rot. Bonds2

About 4-[(dimethylamino)methyl]-N-methylpiperidine-1-carboxamide

4-[(dimethylamino)methyl]-N-methylpiperidine-1-carboxamide (PubChem CID 115583877) has the molecular formula C10H21N3O and a molecular weight of 199.30 g/mol. Its IUPAC name is 4-[(dimethylamino)methyl]-N-methylpiperidine-1-carboxamide.

Molecular Properties

Compound Name4-[(dimethylamino)methyl]-N-methylpiperidine-1-carboxamide
PubChem CID115583877
Molecular FormulaC10H21N3O
Molecular Weight199.30 g/mol
Exact Mass199.17
IUPAC Name4-[(dimethylamino)methyl]-N-methylpiperidine-1-carboxamide
SMILESCNC(=O)N1CCC(CN(C)C)CC1
InChIInChI=1S/C10H21N3O/c1-11-10(14)13-6-4-9(5-7-13)8-12(2)3/h9H,4-8H2,1-3H3,(H,11,14)
InChIKeyQRMQGQGCTBKQPV-UHFFFAOYSA-N
XLogP0.60
TPSA35.58 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms14
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500199.30
LogP ≤ 50.60
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 4-[(dimethylamino)methyl]-N-methylpiperidine-1-carboxamide?
The IUPAC name of 4-[(dimethylamino)methyl]-N-methylpiperidine-1-carboxamide (CID 115583877) is 4-[(dimethylamino)methyl]-N-methylpiperidine-1-carboxamide.
What is the SMILES notation for 4-[(dimethylamino)methyl]-N-methylpiperidine-1-carboxamide?
The canonical SMILES for 4-[(dimethylamino)methyl]-N-methylpiperidine-1-carboxamide is CNC(=O)N1CCC(CN(C)C)CC1.
What is the InChIKey of 4-[(dimethylamino)methyl]-N-methylpiperidine-1-carboxamide?
The InChIKey is QRMQGQGCTBKQPV-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H21N3O/c1-11-10(14)13-6-4-9(5-7-13)8-12(2)3/h9H,4-8H2,1-3H3,(H,11,14).
What are the key properties of 4-[(dimethylamino)methyl]-N-methylpiperidine-1-carboxamide?
4-[(dimethylamino)methyl]-N-methylpiperidine-1-carboxamide has a molecular weight of 199.30 g/mol, XLogP of 0.60, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(dimethylamino)methyl]-N-methylpiperidine-1-carboxamide is sourced from PubChem (CID 115583877), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).