2-N-(cyclopropylmethyl)hexane-1,2-diamine

C10H22N2 — CID 65384187

IUPAC2-N-(cyclopropylmethyl)hexane-1,2-diamine
SMILESCCCCC(CN)NCC1CC1
InChIInChI=1S/C10H22N2/c1-2-3-4-10(7-11)12-8-9-5-6-9/h9-10,12H,2-8,11H2,1H3
InChIKeyCUZNLBPAQNTKQL-UHFFFAOYSA-N
MW170.30 g/mol
LogP1.50
Rot. Bonds7

About 2-N-(cyclopropylmethyl)hexane-1,2-diamine

2-N-(cyclopropylmethyl)hexane-1,2-diamine (PubChem CID 65384187) has the molecular formula C10H22N2 and a molecular weight of 170.30 g/mol. Its IUPAC name is 2-N-(cyclopropylmethyl)hexane-1,2-diamine.

Molecular Properties

Compound Name2-N-(cyclopropylmethyl)hexane-1,2-diamine
PubChem CID65384187
Molecular FormulaC10H22N2
Molecular Weight170.30 g/mol
Exact Mass170.18
IUPAC Name2-N-(cyclopropylmethyl)hexane-1,2-diamine
SMILESCCCCC(CN)NCC1CC1
InChIInChI=1S/C10H22N2/c1-2-3-4-10(7-11)12-8-9-5-6-9/h9-10,12H,2-8,11H2,1H3
InChIKeyCUZNLBPAQNTKQL-UHFFFAOYSA-N
XLogP1.50
TPSA38.05 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500170.30
LogP ≤ 51.50
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2-N-(cyclopropylmethyl)-4-ethylsulfanylbutane-1,2-diamine
CID 116504161
N-(1-aminohexan-2-yl)-2-(cyclopropylmethylamino)acetamide
CID 122080965
2-N-propan-2-ylhexane-1,2-diamine
CID 62070850
N-(2-hexylnonyl)-N-methyl-4-[(pentadecan-8-ylamino)methyl]cyclohexan-1-amine
CID 170250372
2-N-cyclopropyloctane-1,2-diamine
CID 62069624
2-N-[(4-ethylcyclohexyl)methyl]propane-1,2-diamine
CID 103389347
2-N-(3-cyclopropylpropyl)-5-methylsulfanylpentane-1,2-diamine
CID 103089081
4-N-(cyclohexylmethyl)-5-methoxypentane-1,4-diamine
CID 103387807
2-(cyclopropylmethylamino)heptanenitrile
CID 60996351
N-[(4-methylcyclohexyl)methyl]nonan-2-amine
CID 63464065
2-N-(2-methylpropyl)nonane-1,2-diamine
CID 65385407
N-(1-aminohexan-2-yl)cyclohexanecarboxamide
CID 80697500

Frequently Asked Questions

What is the IUPAC name of 2-N-(cyclopropylmethyl)hexane-1,2-diamine?
The IUPAC name of 2-N-(cyclopropylmethyl)hexane-1,2-diamine (CID 65384187) is 2-N-(cyclopropylmethyl)hexane-1,2-diamine.
What is the SMILES notation for 2-N-(cyclopropylmethyl)hexane-1,2-diamine?
The canonical SMILES for 2-N-(cyclopropylmethyl)hexane-1,2-diamine is CCCCC(CN)NCC1CC1.
What is the InChIKey of 2-N-(cyclopropylmethyl)hexane-1,2-diamine?
The InChIKey is CUZNLBPAQNTKQL-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H22N2/c1-2-3-4-10(7-11)12-8-9-5-6-9/h9-10,12H,2-8,11H2,1H3.
What are the key properties of 2-N-(cyclopropylmethyl)hexane-1,2-diamine?
2-N-(cyclopropylmethyl)hexane-1,2-diamine has a molecular weight of 170.30 g/mol, XLogP of 1.50, 7 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-N-(cyclopropylmethyl)hexane-1,2-diamine is sourced from PubChem (CID 65384187), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).