3-(methylaminomethyl)-N-propylpyrrolidine-1-carboxamide

C10H21N3O — CID 63264228

IUPAC3-(methylaminomethyl)-N-propylpyrrolidine-1-carboxamide
SMILESCCCNC(=O)N1CCC(CNC)C1
InChIInChI=1S/C10H21N3O/c1-3-5-12-10(14)13-6-4-9(8-13)7-11-2/h9,11H,3-8H2,1-2H3,(H,12,14)
InChIKeyQLDNONRYCJIXRO-UHFFFAOYSA-N
MW199.30 g/mol
LogP0.65
Rot. Bonds4

About 3-(methylaminomethyl)-N-propylpyrrolidine-1-carboxamide

3-(methylaminomethyl)-N-propylpyrrolidine-1-carboxamide (PubChem CID 63264228) has the molecular formula C10H21N3O and a molecular weight of 199.30 g/mol. Its IUPAC name is 3-(methylaminomethyl)-N-propylpyrrolidine-1-carboxamide.

Molecular Properties

Compound Name3-(methylaminomethyl)-N-propylpyrrolidine-1-carboxamide
PubChem CID63264228
Molecular FormulaC10H21N3O
Molecular Weight199.30 g/mol
Exact Mass199.17
IUPAC Name3-(methylaminomethyl)-N-propylpyrrolidine-1-carboxamide
SMILESCCCNC(=O)N1CCC(CNC)C1
InChIInChI=1S/C10H21N3O/c1-3-5-12-10(14)13-6-4-9(8-13)7-11-2/h9,11H,3-8H2,1-2H3,(H,12,14)
InChIKeyQLDNONRYCJIXRO-UHFFFAOYSA-N
XLogP0.65
TPSA44.37 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500199.30
LogP ≤ 50.65
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

3-(hydroxymethyl)-N-propylpyrrolidine-1-carboxamide
CID 62371161
N-butyl-4-(methylaminomethyl)piperidine-1-carboxamide
CID 63249024
4-(ethylaminomethyl)-N-propylpiperidine-1-carboxamide
CID 80552356
3-amino-N-propylpiperidine-1-carboxamide
CID 61295715
2-[1-(propylcarbamoyl)piperidin-4-yl]acetic acid
CID 29080141
ethane;1-[3-(methylaminomethyl)pyrrolidin-1-yl]propan-1-one;molecular hydrogen
CID 144853305
4-methyl-N-propylpiperidine-1-carboxamide
CID 19169940
5-[4-(methylaminomethyl)piperidin-1-yl]-5-oxo-N-propylpentanamide
CID 119546405
3-(cyclopropylmethoxy)-N-propylpyrrolidine-1-carboxamide
CID 121197651
azepan-1-yl-[3-(methylaminomethyl)pyrrolidin-1-yl]methanone
CID 79152654
2,2-difluoro-1-[3-(methylaminomethyl)pyrrolidin-1-yl]ethanone
CID 103514154
(2R)-2-[[3-(methylaminomethyl)piperidine-1-carbonyl]amino]pentanoic acid
CID 107566360

Frequently Asked Questions

What is the IUPAC name of 3-(methylaminomethyl)-N-propylpyrrolidine-1-carboxamide?
The IUPAC name of 3-(methylaminomethyl)-N-propylpyrrolidine-1-carboxamide (CID 63264228) is 3-(methylaminomethyl)-N-propylpyrrolidine-1-carboxamide.
What is the SMILES notation for 3-(methylaminomethyl)-N-propylpyrrolidine-1-carboxamide?
The canonical SMILES for 3-(methylaminomethyl)-N-propylpyrrolidine-1-carboxamide is CCCNC(=O)N1CCC(CNC)C1.
What is the InChIKey of 3-(methylaminomethyl)-N-propylpyrrolidine-1-carboxamide?
The InChIKey is QLDNONRYCJIXRO-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H21N3O/c1-3-5-12-10(14)13-6-4-9(8-13)7-11-2/h9,11H,3-8H2,1-2H3,(H,12,14).
What are the key properties of 3-(methylaminomethyl)-N-propylpyrrolidine-1-carboxamide?
3-(methylaminomethyl)-N-propylpyrrolidine-1-carboxamide has a molecular weight of 199.30 g/mol, XLogP of 0.65, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(methylaminomethyl)-N-propylpyrrolidine-1-carboxamide is sourced from PubChem (CID 63264228), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).