4-N-(dicyclopropylmethyl)-1-N,1-N-diethylpentane-1,4-diamine

C16H32N2 — CID 43362773

IUPAC4-N-(dicyclopropylmethyl)-1-N,1-N-diethylpentane-1,4-diamine
SMILESCCN(CC)CCCC(C)NC(C1CC1)C1CC1
InChIInChI=1S/C16H32N2/c1-4-18(5-2)12-6-7-13(3)17-16(14-8-9-14)15-10-11-15/h13-17H,4-12H2,1-3H3
InChIKeyIPGHSWIZQGFVRZ-UHFFFAOYSA-N
MW252.45 g/mol
LogP3.28
Rot. Bonds10

About 4-N-(dicyclopropylmethyl)-1-N,1-N-diethylpentane-1,4-diamine

4-N-(dicyclopropylmethyl)-1-N,1-N-diethylpentane-1,4-diamine (PubChem CID 43362773) has the molecular formula C16H32N2 and a molecular weight of 252.45 g/mol. Its IUPAC name is 4-N-(dicyclopropylmethyl)-1-N,1-N-diethylpentane-1,4-diamine.

Molecular Properties

Compound Name4-N-(dicyclopropylmethyl)-1-N,1-N-diethylpentane-1,4-diamine
PubChem CID43362773
Molecular FormulaC16H32N2
Molecular Weight252.45 g/mol
Exact Mass252.26
IUPAC Name4-N-(dicyclopropylmethyl)-1-N,1-N-diethylpentane-1,4-diamine
SMILESCCN(CC)CCCC(C)NC(C1CC1)C1CC1
InChIInChI=1S/C16H32N2/c1-4-18(5-2)12-6-7-13(3)17-16(14-8-9-14)15-10-11-15/h13-17H,4-12H2,1-3H3
InChIKeyIPGHSWIZQGFVRZ-UHFFFAOYSA-N
XLogP3.28
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds10
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.45
LogP ≤ 53.28
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

4-N-(1-cyclohexylethyl)-1-N,1-N-diethylpentane-1,4-diamine
CID 43761162
4-N-cyclopropyl-1-N,1-N-diethylpentane-1,4-diamine
CID 103438826
N,N-diethyl-4-hydrazinylpentan-1-amine
CID 143055875
4-N-(1,1-difluoropropan-2-yl)-1-N,1-N-diethylpentane-1,4-diamine
CID 102867785
1-cyclopropyl-N',N'-diethylbutane-1,4-diamine;dihydrochloride
CID 69456061
4-N-[2-(diethylamino)ethyl]-1-N,1-N-diethylpentane-1,4-diamine
CID 43199211
4-N-[1-(2-bicyclo[2.2.1]hept-5-enyl)ethyl]-1-N,1-N-diethylpentane-1,4-diamine
CID 43761165
2-[5-(diethylamino)pentan-2-ylamino]-N-propylpropanamide
CID 43087341
1-N,1-N-diethyl-4-N-(1-methylsulfonylpropan-2-yl)pentane-1,4-diamine
CID 64629299
2-[5-(diethylamino)pentan-2-ylamino]-3-methylbutanoic acid
CID 103233778
1-N,1-N-diethyl-4-N-[4-(trifluoromethyl)cyclohexyl]pentane-1,4-diamine
CID 64754640
2-N-(dicyclopropylmethyl)-1-N,1-N-dimethylpropane-1,2-diamine
CID 82946340

Frequently Asked Questions

What is the IUPAC name of 4-N-(dicyclopropylmethyl)-1-N,1-N-diethylpentane-1,4-diamine?
The IUPAC name of 4-N-(dicyclopropylmethyl)-1-N,1-N-diethylpentane-1,4-diamine (CID 43362773) is 4-N-(dicyclopropylmethyl)-1-N,1-N-diethylpentane-1,4-diamine.
What is the SMILES notation for 4-N-(dicyclopropylmethyl)-1-N,1-N-diethylpentane-1,4-diamine?
The canonical SMILES for 4-N-(dicyclopropylmethyl)-1-N,1-N-diethylpentane-1,4-diamine is CCN(CC)CCCC(C)NC(C1CC1)C1CC1.
What is the InChIKey of 4-N-(dicyclopropylmethyl)-1-N,1-N-diethylpentane-1,4-diamine?
The InChIKey is IPGHSWIZQGFVRZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H32N2/c1-4-18(5-2)12-6-7-13(3)17-16(14-8-9-14)15-10-11-15/h13-17H,4-12H2,1-3H3.
What are the key properties of 4-N-(dicyclopropylmethyl)-1-N,1-N-diethylpentane-1,4-diamine?
4-N-(dicyclopropylmethyl)-1-N,1-N-diethylpentane-1,4-diamine has a molecular weight of 252.45 g/mol, XLogP of 3.28, 10 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-N-(dicyclopropylmethyl)-1-N,1-N-diethylpentane-1,4-diamine is sourced from PubChem (CID 43362773), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).