1-N'-cyclopentyl-1-N-propylpropane-1,1-diamine

C11H24N2 — CID 173232386

IUPAC1-N'-cyclopentyl-1-N-propylpropane-1,1-diamine
SMILESCCCNC(CC)NC1CCCC1
InChIInChI=1S/C11H24N2/c1-3-9-12-11(4-2)13-10-7-5-6-8-10/h10-13H,3-9H2,1-2H3
InChIKeyZXPZSNISFYQYHN-UHFFFAOYSA-N
MW184.33 g/mol
LogP2.25
Rot. Bonds6

About 1-N'-cyclopentyl-1-N-propylpropane-1,1-diamine

1-N'-cyclopentyl-1-N-propylpropane-1,1-diamine (PubChem CID 173232386) has the molecular formula C11H24N2 and a molecular weight of 184.33 g/mol. Its IUPAC name is 1-N'-cyclopentyl-1-N-propylpropane-1,1-diamine.

Molecular Properties

Compound Name1-N'-cyclopentyl-1-N-propylpropane-1,1-diamine
PubChem CID173232386
Molecular FormulaC11H24N2
Molecular Weight184.33 g/mol
Exact Mass184.19
IUPAC Name1-N'-cyclopentyl-1-N-propylpropane-1,1-diamine
SMILESCCCNC(CC)NC1CCCC1
InChIInChI=1S/C11H24N2/c1-3-9-12-11(4-2)13-10-7-5-6-8-10/h10-13H,3-9H2,1-2H3
InChIKeyZXPZSNISFYQYHN-UHFFFAOYSA-N
XLogP2.25
TPSA24.06 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500184.33
LogP ≤ 52.25
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}

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Related Compounds

1-cyclododecyl-N-propylpropan-1-amine
CID 79308094
N-[cyclohexyl(cyclooctyl)methyl]propan-1-amine
CID 80609458
N-(1-cyclopentylethyl)propan-1-amine
CID 60819417
N-[(1R)-1-cyclopentylethyl]propan-1-amine
CID 81395735
N-[(1R)-1-cycloheptylethyl]propan-1-amine
CID 81393503
1-cycloheptyl-2,2-dimethyl-N-propylbutan-1-amine
CID 105027902
1-cyclooctyl-3-methyl-N-propylbutan-1-amine
CID 80611346
N-(1-methylsulfanylbutan-2-yl)cyclohexanamine
CID 115901653
1-cyclopentyl-2-methoxy-N-propylbutan-1-amine
CID 116716165
N-(1-cyclohexyl-2-cyclopropylethyl)propan-1-amine
CID 64906584
azane;N-propylcyclohexanamine
CID 19368218
N-propylcyclohexanamine;hydrochloride
CID 17370003

Frequently Asked Questions

What is the IUPAC name of 1-N'-cyclopentyl-1-N-propylpropane-1,1-diamine?
The IUPAC name of 1-N'-cyclopentyl-1-N-propylpropane-1,1-diamine (CID 173232386) is 1-N'-cyclopentyl-1-N-propylpropane-1,1-diamine.
What is the SMILES notation for 1-N'-cyclopentyl-1-N-propylpropane-1,1-diamine?
The canonical SMILES for 1-N'-cyclopentyl-1-N-propylpropane-1,1-diamine is CCCNC(CC)NC1CCCC1.
What is the InChIKey of 1-N'-cyclopentyl-1-N-propylpropane-1,1-diamine?
The InChIKey is ZXPZSNISFYQYHN-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H24N2/c1-3-9-12-11(4-2)13-10-7-5-6-8-10/h10-13H,3-9H2,1-2H3.
What are the key properties of 1-N'-cyclopentyl-1-N-propylpropane-1,1-diamine?
1-N'-cyclopentyl-1-N-propylpropane-1,1-diamine has a molecular weight of 184.33 g/mol, XLogP of 2.25, 6 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-N'-cyclopentyl-1-N-propylpropane-1,1-diamine is sourced from PubChem (CID 173232386), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).