1-cyclopentyl-1,3-dimethyl-3-(2-piperidin-4-ylethyl)urea

C15H29N3O — CID 66990283

IUPAC1-cyclopentyl-1,3-dimethyl-3-(2-piperidin-4-ylethyl)urea
SMILESCN(CCC1CCNCC1)C(=O)N(C)C1CCCC1
InChIInChI=1S/C15H29N3O/c1-17(12-9-13-7-10-16-11-8-13)15(19)18(2)14-5-3-4-6-14/h13-14,16H,3-12H2,1-2H3
InChIKeyKMQPKSYIFACDKJ-UHFFFAOYSA-N
MW267.42 g/mol
LogP2.30
Rot. Bonds4

About 1-cyclopentyl-1,3-dimethyl-3-(2-piperidin-4-ylethyl)urea

1-cyclopentyl-1,3-dimethyl-3-(2-piperidin-4-ylethyl)urea (PubChem CID 66990283) has the molecular formula C15H29N3O and a molecular weight of 267.42 g/mol. Its IUPAC name is 1-cyclopentyl-1,3-dimethyl-3-(2-piperidin-4-ylethyl)urea.

Molecular Properties

Compound Name1-cyclopentyl-1,3-dimethyl-3-(2-piperidin-4-ylethyl)urea
PubChem CID66990283
Molecular FormulaC15H29N3O
Molecular Weight267.42 g/mol
Exact Mass267.23
IUPAC Name1-cyclopentyl-1,3-dimethyl-3-(2-piperidin-4-ylethyl)urea
SMILESCN(CCC1CCNCC1)C(=O)N(C)C1CCCC1
InChIInChI=1S/C15H29N3O/c1-17(12-9-13-7-10-16-11-8-13)15(19)18(2)14-5-3-4-6-14/h13-14,16H,3-12H2,1-2H3
InChIKeyKMQPKSYIFACDKJ-UHFFFAOYSA-N
XLogP2.30
TPSA35.58 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.42
LogP ≤ 52.30
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-Isopropyl-3,9-diazaspiro[5.5]undecane-3-carboxamide
CID 3234223
3-Methyl-1-(1-methylpiperidin-4-yl)urea
CID 59833286
1-[(Piperidin-4-yl)methyl]imidazolidin-2-one
CID 61649405
3-Methyl-1-((piperidin-4-yl)methyl)urea hydrochloride
CID 134691041
1-Cyclopropyl-3-[2-(4-methylpiperidin-1-yl)ethyl]urea
CID 47038655
3-(dimethylamino)-N-(3,3-dimethylbutyl)piperidine-1-carboxamide
CID 72145167
N-cyclopentyl-3-(1-methyl-4-piperidyl)-1-pyrrolidinecarboxamide
CID 91921271
2-methyl-N-propylpiperidine-1-carboxamide
CID 6468414
1-(1-Ethylpiperidin-4-yl)-3-propylurea
CID 6468806
3,3-Dimethyl-1-(piperidin-4-yl)urea
CID 18677692
4-amino-N-tert-butylpiperidine-1-carboxamide
CID 28785595
3,3-Dimethyl-1-((1-methylpiperidin-4-yl)methyl)urea
CID 112688391

Frequently Asked Questions

What is the IUPAC name of 1-cyclopentyl-1,3-dimethyl-3-(2-piperidin-4-ylethyl)urea?
The IUPAC name of 1-cyclopentyl-1,3-dimethyl-3-(2-piperidin-4-ylethyl)urea (CID 66990283) is 1-cyclopentyl-1,3-dimethyl-3-(2-piperidin-4-ylethyl)urea.
What is the SMILES notation for 1-cyclopentyl-1,3-dimethyl-3-(2-piperidin-4-ylethyl)urea?
The canonical SMILES for 1-cyclopentyl-1,3-dimethyl-3-(2-piperidin-4-ylethyl)urea is CN(CCC1CCNCC1)C(=O)N(C)C1CCCC1.
What is the InChIKey of 1-cyclopentyl-1,3-dimethyl-3-(2-piperidin-4-ylethyl)urea?
The InChIKey is KMQPKSYIFACDKJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H29N3O/c1-17(12-9-13-7-10-16-11-8-13)15(19)18(2)14-5-3-4-6-14/h13-14,16H,3-12H2,1-2H3.
What are the key properties of 1-cyclopentyl-1,3-dimethyl-3-(2-piperidin-4-ylethyl)urea?
1-cyclopentyl-1,3-dimethyl-3-(2-piperidin-4-ylethyl)urea has a molecular weight of 267.42 g/mol, XLogP of 2.30, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclopentyl-1,3-dimethyl-3-(2-piperidin-4-ylethyl)urea is sourced from PubChem (CID 66990283), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).