3-(dipropylamino)-N-propylazetidine-1-carboxamide

C13H27N3O — CID 23140247

IUPAC3-(dipropylamino)-N-propylazetidine-1-carboxamide
SMILESCCCNC(=O)N1CC(N(CCC)CCC)C1
InChIInChI=1S/C13H27N3O/c1-4-7-14-13(17)16-10-12(11-16)15(8-5-2)9-6-3/h12H,4-11H2,1-3H3,(H,14,17)
InChIKeyGJRWBOUQRUYQDO-UHFFFAOYSA-N
MW241.38 g/mol
LogP1.91
Rot. Bonds7

About 3-(dipropylamino)-N-propylazetidine-1-carboxamide

3-(dipropylamino)-N-propylazetidine-1-carboxamide (PubChem CID 23140247) has the molecular formula C13H27N3O and a molecular weight of 241.38 g/mol. Its IUPAC name is 3-(dipropylamino)-N-propylazetidine-1-carboxamide.

Molecular Properties

Compound Name3-(dipropylamino)-N-propylazetidine-1-carboxamide
PubChem CID23140247
Molecular FormulaC13H27N3O
Molecular Weight241.38 g/mol
Exact Mass241.22
IUPAC Name3-(dipropylamino)-N-propylazetidine-1-carboxamide
SMILESCCCNC(=O)N1CC(N(CCC)CCC)C1
InChIInChI=1S/C13H27N3O/c1-4-7-14-13(17)16-10-12(11-16)15(8-5-2)9-6-3/h12H,4-11H2,1-3H3,(H,14,17)
InChIKeyGJRWBOUQRUYQDO-UHFFFAOYSA-N
XLogP1.91
TPSA35.58 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.38
LogP ≤ 51.91
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-Isopropylpiperazine-1-carboxamide
CID 16740267
3-methyl-N-(propan-2-yl)piperazine-1-carboxamide
CID 53933480
3-amino-N,N-dimethylazetidine-1-carboxamide
CID 79154312
3-amino-N-methylazetidine-1-carboxamide
CID 81908858
3-amino-N-methylazetidine-1-carboxamide hydrochloride
CID 137966080
N,N,N'-Tripropan-2-ylurea
CID 12829063
N-propan-2-ylazetidine-1-carboxamide
CID 126972093
3-Butan-2-yl-1,1-bis[2-(dimethylamino)ethyl]urea
CID 53621554
3-Cyclopropyl-1,1-bis[2-(dimethylamino)ethyl]urea
CID 53621558
1-[2-[Butan-2-yl(methyl)amino]ethyl]-3-cyclopropylurea
CID 71934037
3-Aminoazetidine-1-carboxamide
CID 63766744
1-(Azetidin-3-yl)imidazolidin-2-one
CID 66187743

Frequently Asked Questions

What is the IUPAC name of 3-(dipropylamino)-N-propylazetidine-1-carboxamide?
The IUPAC name of 3-(dipropylamino)-N-propylazetidine-1-carboxamide (CID 23140247) is 3-(dipropylamino)-N-propylazetidine-1-carboxamide.
What is the SMILES notation for 3-(dipropylamino)-N-propylazetidine-1-carboxamide?
The canonical SMILES for 3-(dipropylamino)-N-propylazetidine-1-carboxamide is CCCNC(=O)N1CC(N(CCC)CCC)C1.
What is the InChIKey of 3-(dipropylamino)-N-propylazetidine-1-carboxamide?
The InChIKey is GJRWBOUQRUYQDO-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H27N3O/c1-4-7-14-13(17)16-10-12(11-16)15(8-5-2)9-6-3/h12H,4-11H2,1-3H3,(H,14,17).
What are the key properties of 3-(dipropylamino)-N-propylazetidine-1-carboxamide?
3-(dipropylamino)-N-propylazetidine-1-carboxamide has a molecular weight of 241.38 g/mol, XLogP of 1.91, 7 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(dipropylamino)-N-propylazetidine-1-carboxamide is sourced from PubChem (CID 23140247), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).