1-cyclopentyl-3-[1-(dimethylamino)propan-2-yl]urea

C11H23N3O — CID 116657212

IUPAC1-cyclopentyl-3-[1-(dimethylamino)propan-2-yl]urea
SMILESCC(CN(C)C)NC(=O)NC1CCCC1
InChIInChI=1S/C11H23N3O/c1-9(8-14(2)3)12-11(15)13-10-6-4-5-7-10/h9-10H,4-8H2,1-3H3,(H2,12,13,15)
InChIKeyPPMKDKLKQQIWJP-UHFFFAOYSA-N
MW213.32 g/mol
LogP1.18
Rot. Bonds4

About 1-cyclopentyl-3-[1-(dimethylamino)propan-2-yl]urea

1-cyclopentyl-3-[1-(dimethylamino)propan-2-yl]urea (PubChem CID 116657212) has the molecular formula C11H23N3O and a molecular weight of 213.32 g/mol. Its IUPAC name is 1-cyclopentyl-3-[1-(dimethylamino)propan-2-yl]urea.

Molecular Properties

Compound Name1-cyclopentyl-3-[1-(dimethylamino)propan-2-yl]urea
PubChem CID116657212
Molecular FormulaC11H23N3O
Molecular Weight213.32 g/mol
Exact Mass213.18
IUPAC Name1-cyclopentyl-3-[1-(dimethylamino)propan-2-yl]urea
SMILESCC(CN(C)C)NC(=O)NC1CCCC1
InChIInChI=1S/C11H23N3O/c1-9(8-14(2)3)12-11(15)13-10-6-4-5-7-10/h9-10H,4-8H2,1-3H3,(H2,12,13,15)
InChIKeyPPMKDKLKQQIWJP-UHFFFAOYSA-N
XLogP1.18
TPSA44.37 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500213.32
LogP ≤ 51.18
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

1-cyclopentyl-3-[1-(dimethylamino)-4-methylpentan-2-yl]urea
CID 86811911
1-cyclopentyl-3-[(2S)-1-fluoropropan-2-yl]urea
CID 127009415
1-cyclopentyl-3-(1-methylsulfanylpropan-2-yl)urea
CID 115640204
2-cyclohexyl-2-[1-(dimethylamino)propan-2-ylcarbamoylamino]acetic acid
CID 82938789
N-cyclohexyl-2-[1-(dimethylamino)propan-2-ylamino]acetamide
CID 82938571
1-cyclopropyl-3-[1-(dimethylamino)-4-methylpentan-2-yl]urea
CID 55769941
1-(4-aminopentan-2-yl)-3-cyclobutylurea
CID 116658905
1-cyclohexyl-3-(4-methylsulfinylbutan-2-yl)urea
CID 115698103
1-cyclopentyl-3-(1-piperidin-1-ylpropan-2-yl)urea
CID 113222806
1-butan-2-yl-3-cyclopropylurea
CID 45366532
1-cyclopropyl-3-[(2R)-1-hydroxypropan-2-yl]urea
CID 62950697
1-cyclopropyl-3-[1-(dimethylamino)propan-2-yl]thiourea
CID 116509742

Frequently Asked Questions

What is the IUPAC name of 1-cyclopentyl-3-[1-(dimethylamino)propan-2-yl]urea?
The IUPAC name of 1-cyclopentyl-3-[1-(dimethylamino)propan-2-yl]urea (CID 116657212) is 1-cyclopentyl-3-[1-(dimethylamino)propan-2-yl]urea.
What is the SMILES notation for 1-cyclopentyl-3-[1-(dimethylamino)propan-2-yl]urea?
The canonical SMILES for 1-cyclopentyl-3-[1-(dimethylamino)propan-2-yl]urea is CC(CN(C)C)NC(=O)NC1CCCC1.
What is the InChIKey of 1-cyclopentyl-3-[1-(dimethylamino)propan-2-yl]urea?
The InChIKey is PPMKDKLKQQIWJP-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H23N3O/c1-9(8-14(2)3)12-11(15)13-10-6-4-5-7-10/h9-10H,4-8H2,1-3H3,(H2,12,13,15).
What are the key properties of 1-cyclopentyl-3-[1-(dimethylamino)propan-2-yl]urea?
1-cyclopentyl-3-[1-(dimethylamino)propan-2-yl]urea has a molecular weight of 213.32 g/mol, XLogP of 1.18, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclopentyl-3-[1-(dimethylamino)propan-2-yl]urea is sourced from PubChem (CID 116657212), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).