1-N-(2-aminopentyl)pentane-1,2-diamine

C10H25N3 — CID 139611076

IUPAC1-N-(2-aminopentyl)pentane-1,2-diamine
SMILESCCCC(N)CNCC(N)CCC
InChIInChI=1S/C10H25N3/c1-3-5-9(11)7-13-8-10(12)6-4-2/h9-10,13H,3-8,11-12H2,1-2H3
InChIKeyKNQYQFZIDOEAMF-UHFFFAOYSA-N
MW187.33 g/mol
LogP0.83
Rot. Bonds8

About 1-N-(2-aminopentyl)pentane-1,2-diamine

1-N-(2-aminopentyl)pentane-1,2-diamine (PubChem CID 139611076) has the molecular formula C10H25N3 and a molecular weight of 187.33 g/mol. Its IUPAC name is 1-N-(2-aminopentyl)pentane-1,2-diamine.

Molecular Properties

Compound Name1-N-(2-aminopentyl)pentane-1,2-diamine
PubChem CID139611076
Molecular FormulaC10H25N3
Molecular Weight187.33 g/mol
Exact Mass187.20
IUPAC Name1-N-(2-aminopentyl)pentane-1,2-diamine
SMILESCCCC(N)CNCC(N)CCC
InChIInChI=1S/C10H25N3/c1-3-5-9(11)7-13-8-10(12)6-4-2/h9-10,13H,3-8,11-12H2,1-2H3
InChIKeyKNQYQFZIDOEAMF-UHFFFAOYSA-N
XLogP0.83
TPSA64.07 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500187.33
LogP ≤ 50.83
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

1-N-(7-methyloctyl)pentane-1,2-diamine
CID 107815807
azane;heptan-4-amine
CID 118430725
(2S)-1-N-propyldecane-1,2-diamine
CID 135223941
1-N-(2,3,3-trimethylbutyl)hexane-1,2-diamine
CID 83144065
ethane;hexan-3-amine
CID 143616305
4-methoxy-1-N-propylbutane-1,2-diamine
CID 62477493
2-(2-aminohexylamino)ethanol
CID 83960481
1-N-(1,3-thiazol-4-ylmethyl)pentane-1,2-diamine
CID 63826089
ethane;hexan-3-amine;methane
CID 145152462
N-(2-aminopentyl)-2-ethylbutanamide
CID 115737781
5-N-(2-aminohexyl)pentane-1,2,5-triamine
CID 88775596
N-(2-aminopentyl)pentanamide
CID 115737691

Frequently Asked Questions

What is the IUPAC name of 1-N-(2-aminopentyl)pentane-1,2-diamine?
The IUPAC name of 1-N-(2-aminopentyl)pentane-1,2-diamine (CID 139611076) is 1-N-(2-aminopentyl)pentane-1,2-diamine.
What is the SMILES notation for 1-N-(2-aminopentyl)pentane-1,2-diamine?
The canonical SMILES for 1-N-(2-aminopentyl)pentane-1,2-diamine is CCCC(N)CNCC(N)CCC.
What is the InChIKey of 1-N-(2-aminopentyl)pentane-1,2-diamine?
The InChIKey is KNQYQFZIDOEAMF-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H25N3/c1-3-5-9(11)7-13-8-10(12)6-4-2/h9-10,13H,3-8,11-12H2,1-2H3.
What are the key properties of 1-N-(2-aminopentyl)pentane-1,2-diamine?
1-N-(2-aminopentyl)pentane-1,2-diamine has a molecular weight of 187.33 g/mol, XLogP of 0.83, 8 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-N-(2-aminopentyl)pentane-1,2-diamine is sourced from PubChem (CID 139611076), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).