N'-cyclopropyl-2-methylbutane-1,4-diamine

C8H18N2 — CID 79001550

IUPACN'-cyclopropyl-2-methylbutane-1,4-diamine
SMILESCC(CN)CCNC1CC1
InChIInChI=1S/C8H18N2/c1-7(6-9)4-5-10-8-2-3-8/h7-8,10H,2-6,9H2,1H3
InChIKeyUSWGABIVQLDGQU-UHFFFAOYSA-N
MW142.25 g/mol
LogP0.72
Rot. Bonds5

About N'-cyclopropyl-2-methylbutane-1,4-diamine

N'-cyclopropyl-2-methylbutane-1,4-diamine (PubChem CID 79001550) has the molecular formula C8H18N2 and a molecular weight of 142.25 g/mol. Its IUPAC name is N'-cyclopropyl-2-methylbutane-1,4-diamine.

Molecular Properties

Compound NameN'-cyclopropyl-2-methylbutane-1,4-diamine
PubChem CID79001550
Molecular FormulaC8H18N2
Molecular Weight142.25 g/mol
Exact Mass142.15
IUPAC NameN'-cyclopropyl-2-methylbutane-1,4-diamine
SMILESCC(CN)CCNC1CC1
InChIInChI=1S/C8H18N2/c1-7(6-9)4-5-10-8-2-3-8/h7-8,10H,2-6,9H2,1H3
InChIKeyUSWGABIVQLDGQU-UHFFFAOYSA-N
XLogP0.72
TPSA38.05 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500142.25
LogP ≤ 50.72
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N'-cyclobutyl-2-methylpentane-1,5-diamine
CID 82682689
2-methyl-N'-(1-methylpiperidin-3-yl)butane-1,4-diamine
CID 115203024
N'-(1-cyclopropylpyrrolidin-3-yl)-2-methylbutane-1,4-diamine
CID 81079562
N-(3-methyloctyl)cyclopropanamine
CID 81018953
N,N'-dicyclopropyl-4-methylheptane-1,7-diamine
CID 66322125
N-(3-methylpentadecyl)cyclopropanamine
CID 81020007
N'-(2-methoxycyclopentyl)-2-methylbutane-1,4-diamine
CID 81080842
1-N-cyclopropyl-3-N-ethylbutane-1,3-diamine
CID 62832769
N-(3,5,5-trimethylhexyl)cyclopentanamine
CID 60984290
N'-(cyclopentylmethyl)-2-methylbutane-1,4-diamine
CID 115203257
N'-cyclopropyl-3-methyl-N-propan-2-ylhexane-1,6-diamine
CID 66337356
N-(4-methylhexyl)cyclopropanamine
CID 62529631

Frequently Asked Questions

What is the IUPAC name of N'-cyclopropyl-2-methylbutane-1,4-diamine?
The IUPAC name of N'-cyclopropyl-2-methylbutane-1,4-diamine (CID 79001550) is N'-cyclopropyl-2-methylbutane-1,4-diamine.
What is the SMILES notation for N'-cyclopropyl-2-methylbutane-1,4-diamine?
The canonical SMILES for N'-cyclopropyl-2-methylbutane-1,4-diamine is CC(CN)CCNC1CC1.
What is the InChIKey of N'-cyclopropyl-2-methylbutane-1,4-diamine?
The InChIKey is USWGABIVQLDGQU-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H18N2/c1-7(6-9)4-5-10-8-2-3-8/h7-8,10H,2-6,9H2,1H3.
What are the key properties of N'-cyclopropyl-2-methylbutane-1,4-diamine?
N'-cyclopropyl-2-methylbutane-1,4-diamine has a molecular weight of 142.25 g/mol, XLogP of 0.72, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N'-cyclopropyl-2-methylbutane-1,4-diamine is sourced from PubChem (CID 79001550), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).