2-N-cyclopropyl-1-N-propan-2-yl-2-N-propylpentane-1,2-diamine

C14H30N2 — CID 83043131

IUPAC2-N-cyclopropyl-1-N-propan-2-yl-2-N-propylpentane-1,2-diamine
SMILESCCCC(CNC(C)C)N(CCC)C1CC1
InChIInChI=1S/C14H30N2/c1-5-7-14(11-15-12(3)4)16(10-6-2)13-8-9-13/h12-15H,5-11H2,1-4H3
InChIKeyBZSRBCFZJHKLTC-UHFFFAOYSA-N
MW226.41 g/mol
LogP3.03
Rot. Bonds9

About 2-N-cyclopropyl-1-N-propan-2-yl-2-N-propylpentane-1,2-diamine

2-N-cyclopropyl-1-N-propan-2-yl-2-N-propylpentane-1,2-diamine (PubChem CID 83043131) has the molecular formula C14H30N2 and a molecular weight of 226.41 g/mol. Its IUPAC name is 2-N-cyclopropyl-1-N-propan-2-yl-2-N-propylpentane-1,2-diamine.

Molecular Properties

Compound Name2-N-cyclopropyl-1-N-propan-2-yl-2-N-propylpentane-1,2-diamine
PubChem CID83043131
Molecular FormulaC14H30N2
Molecular Weight226.41 g/mol
Exact Mass226.24
IUPAC Name2-N-cyclopropyl-1-N-propan-2-yl-2-N-propylpentane-1,2-diamine
SMILESCCCC(CNC(C)C)N(CCC)C1CC1
InChIInChI=1S/C14H30N2/c1-5-7-14(11-15-12(3)4)16(10-6-2)13-8-9-13/h12-15H,5-11H2,1-4H3
InChIKeyBZSRBCFZJHKLTC-UHFFFAOYSA-N
XLogP3.03
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds9
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.41
LogP ≤ 53.03
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-hexan-3-yl-N-propylcyclopentanamine
CID 130409572
2-N-cyclohexyl-2-N-methyl-1-N-propan-2-ylpentane-1,2-diamine
CID 83043219
2-N-cyclopropyl-2-N-(2-methylpropyl)-1-N-propan-2-ylbutane-1,2-diamine
CID 62429365
2-N-cyclopropyl-2-N-ethyl-3-methyl-1-N-propan-2-ylbutane-1,2-diamine
CID 62422016
2-N-cyclopropyl-1-N,3-dimethyl-2-N-propylbutane-1,2-diamine
CID 62421973
2-N-cyclopropyl-1-N,2-N-diethylpentane-1,2-diamine
CID 83054723
2-N-methyl-2-N-(3-methylcyclohexyl)-1-N-propan-2-ylpentane-1,2-diamine
CID 83054287
2-N-cyclopentyl-2-N-ethyl-1-N-methylpentane-1,2-diamine
CID 83054821
3-N-cyclopropyl-1-N-(2-methylpropyl)-3-N-propylbutane-1,3-diamine
CID 62420483
N-propan-2-yl-N-propylcyclopentanamine
CID 54134740
2-N-ethyl-1-N-propan-2-yl-2-N-propylbutane-1,2-diamine
CID 62420464
2-N-(cyclopropylmethyl)-1-N-propan-2-yl-2-N-propylbutane-1,2-diamine
CID 62430407

Frequently Asked Questions

What is the IUPAC name of 2-N-cyclopropyl-1-N-propan-2-yl-2-N-propylpentane-1,2-diamine?
The IUPAC name of 2-N-cyclopropyl-1-N-propan-2-yl-2-N-propylpentane-1,2-diamine (CID 83043131) is 2-N-cyclopropyl-1-N-propan-2-yl-2-N-propylpentane-1,2-diamine.
What is the SMILES notation for 2-N-cyclopropyl-1-N-propan-2-yl-2-N-propylpentane-1,2-diamine?
The canonical SMILES for 2-N-cyclopropyl-1-N-propan-2-yl-2-N-propylpentane-1,2-diamine is CCCC(CNC(C)C)N(CCC)C1CC1.
What is the InChIKey of 2-N-cyclopropyl-1-N-propan-2-yl-2-N-propylpentane-1,2-diamine?
The InChIKey is BZSRBCFZJHKLTC-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H30N2/c1-5-7-14(11-15-12(3)4)16(10-6-2)13-8-9-13/h12-15H,5-11H2,1-4H3.
What are the key properties of 2-N-cyclopropyl-1-N-propan-2-yl-2-N-propylpentane-1,2-diamine?
2-N-cyclopropyl-1-N-propan-2-yl-2-N-propylpentane-1,2-diamine has a molecular weight of 226.41 g/mol, XLogP of 3.03, 9 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-N-cyclopropyl-1-N-propan-2-yl-2-N-propylpentane-1,2-diamine is sourced from PubChem (CID 83043131), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).