1-N,1-N-dipropylpentane-1,2-diamine

C11H26N2 — CID 43650406

IUPAC1-N,1-N-dipropylpentane-1,2-diamine
SMILESCCCC(N)CN(CCC)CCC
InChIInChI=1S/C11H26N2/c1-4-7-11(12)10-13(8-5-2)9-6-3/h11H,4-10,12H2,1-3H3
InChIKeyYNIAYYDFMNIJJU-UHFFFAOYSA-N
MW186.34 g/mol
LogP2.24
Rot. Bonds8

About 1-N,1-N-dipropylpentane-1,2-diamine

1-N,1-N-dipropylpentane-1,2-diamine (PubChem CID 43650406) has the molecular formula C11H26N2 and a molecular weight of 186.34 g/mol. Its IUPAC name is 1-N,1-N-dipropylpentane-1,2-diamine.

Molecular Properties

Compound Name1-N,1-N-dipropylpentane-1,2-diamine
PubChem CID43650406
Molecular FormulaC11H26N2
Molecular Weight186.34 g/mol
Exact Mass186.21
IUPAC Name1-N,1-N-dipropylpentane-1,2-diamine
SMILESCCCC(N)CN(CCC)CCC
InChIInChI=1S/C11H26N2/c1-4-7-11(12)10-13(8-5-2)9-6-3/h11H,4-10,12H2,1-3H3
InChIKeyYNIAYYDFMNIJJU-UHFFFAOYSA-N
XLogP2.24
TPSA29.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds8
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500186.34
LogP ≤ 52.24
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

(2S)-1-N,1-N-bis(3-methylbutyl)pentane-1,2-diamine
CID 112737195
(2S)-1-N,1-N-bis(2-aminoethyl)pentane-1,2-diamine
CID 129302821
1-N-ethyl-1-N-propylhexane-1,2-diamine
CID 60854775
1-N-ethyl-1-N-(2-methylpropyl)pentane-1,2-diamine
CID 43650469
N',N',2-tripropylpropane-1,3-diamine
CID 65228607
(2S)-1-N-ethyl-1-N-methylpentane-1,2-diamine
CID 130522075
1-N-butyl-1-N-methylpentane-1,2-diamine
CID 43650417
ethane;hexan-3-amine
CID 143616305
2-[(dipropylamino)methyl]pentanamide
CID 23363408
3-amino-4-(dibutylamino)butan-1-ol
CID 64900069
azane;heptan-4-amine
CID 118430725
ethane;hexan-3-amine;methane
CID 145152462

Frequently Asked Questions

What is the IUPAC name of 1-N,1-N-dipropylpentane-1,2-diamine?
The IUPAC name of 1-N,1-N-dipropylpentane-1,2-diamine (CID 43650406) is 1-N,1-N-dipropylpentane-1,2-diamine.
What is the SMILES notation for 1-N,1-N-dipropylpentane-1,2-diamine?
The canonical SMILES for 1-N,1-N-dipropylpentane-1,2-diamine is CCCC(N)CN(CCC)CCC.
What is the InChIKey of 1-N,1-N-dipropylpentane-1,2-diamine?
The InChIKey is YNIAYYDFMNIJJU-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H26N2/c1-4-7-11(12)10-13(8-5-2)9-6-3/h11H,4-10,12H2,1-3H3.
What are the key properties of 1-N,1-N-dipropylpentane-1,2-diamine?
1-N,1-N-dipropylpentane-1,2-diamine has a molecular weight of 186.34 g/mol, XLogP of 2.24, 8 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-N,1-N-dipropylpentane-1,2-diamine is sourced from PubChem (CID 43650406), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).