2-N-(cyclopentylmethyl)-2-N-methylbutane-1,2-diamine

C11H24N2 — CID 63632440

IUPAC2-N-(cyclopentylmethyl)-2-N-methylbutane-1,2-diamine
SMILESCCC(CN)N(C)CC1CCCC1
InChIInChI=1S/C11H24N2/c1-3-11(8-12)13(2)9-10-6-4-5-7-10/h10-11H,3-9,12H2,1-2H3
InChIKeySJHSGOZYTJOOHW-UHFFFAOYSA-N
MW184.33 g/mol
LogP1.85
Rot. Bonds5

About 2-N-(cyclopentylmethyl)-2-N-methylbutane-1,2-diamine

2-N-(cyclopentylmethyl)-2-N-methylbutane-1,2-diamine (PubChem CID 63632440) has the molecular formula C11H24N2 and a molecular weight of 184.33 g/mol. Its IUPAC name is 2-N-(cyclopentylmethyl)-2-N-methylbutane-1,2-diamine.

Molecular Properties

Compound Name2-N-(cyclopentylmethyl)-2-N-methylbutane-1,2-diamine
PubChem CID63632440
Molecular FormulaC11H24N2
Molecular Weight184.33 g/mol
Exact Mass184.19
IUPAC Name2-N-(cyclopentylmethyl)-2-N-methylbutane-1,2-diamine
SMILESCCC(CN)N(C)CC1CCCC1
InChIInChI=1S/C11H24N2/c1-3-11(8-12)13(2)9-10-6-4-5-7-10/h10-11H,3-9,12H2,1-2H3
InChIKeySJHSGOZYTJOOHW-UHFFFAOYSA-N
XLogP1.85
TPSA29.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500184.33
LogP ≤ 51.85
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-N-(cyclohexylmethyl)-2-N-methylbutane-1,2-diamine
CID 61444608
3-N-(cyclohexylmethyl)-3-N-methylpentane-1,3-diamine
CID 61444292
2-N-methyl-2-N-(oxan-3-ylmethyl)butane-1,2-diamine
CID 63725583
2-N-(cyclohexylmethyl)-2-N,4,4-trimethylpentane-1,2-diamine
CID 62950046
4-amino-3-[cyclohexylmethyl(methyl)amino]butanamide
CID 66427542
4-amino-3-[cyclohexylmethyl(methyl)amino]-N,N-dimethylbutanamide
CID 66429827
2-N-(cyclobutylmethyl)-3-ethyl-2-N-methylpentane-1,2-diamine
CID 62861474
3-[cyclobutylmethyl(methyl)amino]pentanethioamide
CID 62861317
N-(cycloheptylmethyl)-1-cyclopropyl-N-methylethane-1,2-diamine
CID 116651578
N-(cyclohexylmethyl)-1-cyclopropyl-N-methylethane-1,2-diamine
CID 61444896
3-N-methyl-3-N-(oxan-4-ylmethyl)pentane-1,3-diamine
CID 63726447
2-[cyclopentylmethyl(methyl)amino]butanamide
CID 62923981

Frequently Asked Questions

What is the IUPAC name of 2-N-(cyclopentylmethyl)-2-N-methylbutane-1,2-diamine?
The IUPAC name of 2-N-(cyclopentylmethyl)-2-N-methylbutane-1,2-diamine (CID 63632440) is 2-N-(cyclopentylmethyl)-2-N-methylbutane-1,2-diamine.
What is the SMILES notation for 2-N-(cyclopentylmethyl)-2-N-methylbutane-1,2-diamine?
The canonical SMILES for 2-N-(cyclopentylmethyl)-2-N-methylbutane-1,2-diamine is CCC(CN)N(C)CC1CCCC1.
What is the InChIKey of 2-N-(cyclopentylmethyl)-2-N-methylbutane-1,2-diamine?
The InChIKey is SJHSGOZYTJOOHW-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H24N2/c1-3-11(8-12)13(2)9-10-6-4-5-7-10/h10-11H,3-9,12H2,1-2H3.
What are the key properties of 2-N-(cyclopentylmethyl)-2-N-methylbutane-1,2-diamine?
2-N-(cyclopentylmethyl)-2-N-methylbutane-1,2-diamine has a molecular weight of 184.33 g/mol, XLogP of 1.85, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-N-(cyclopentylmethyl)-2-N-methylbutane-1,2-diamine is sourced from PubChem (CID 63632440), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).