1-(aminomethyl)-N-butyl-N-methylcyclopropan-1-amine

C9H20N2 — CID 106661013

IUPAC1-(aminomethyl)-N-butyl-N-methylcyclopropan-1-amine
SMILESCCCCN(C)C1(CN)CC1
InChIInChI=1S/C9H20N2/c1-3-4-7-11(2)9(8-10)5-6-9/h3-8,10H2,1-2H3
InChIKeyPWUAKCZNWAGQBS-UHFFFAOYSA-N
MW156.27 g/mol
LogP1.21
Rot. Bonds5

About 1-(aminomethyl)-N-butyl-N-methylcyclopropan-1-amine

1-(aminomethyl)-N-butyl-N-methylcyclopropan-1-amine (PubChem CID 106661013) has the molecular formula C9H20N2 and a molecular weight of 156.27 g/mol. Its IUPAC name is 1-(aminomethyl)-N-butyl-N-methylcyclopropan-1-amine.

Molecular Properties

Compound Name1-(aminomethyl)-N-butyl-N-methylcyclopropan-1-amine
PubChem CID106661013
Molecular FormulaC9H20N2
Molecular Weight156.27 g/mol
Exact Mass156.16
IUPAC Name1-(aminomethyl)-N-butyl-N-methylcyclopropan-1-amine
SMILESCCCCN(C)C1(CN)CC1
InChIInChI=1S/C9H20N2/c1-3-4-7-11(2)9(8-10)5-6-9/h3-8,10H2,1-2H3
InChIKeyPWUAKCZNWAGQBS-UHFFFAOYSA-N
XLogP1.21
TPSA29.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500156.27
LogP ≤ 51.21
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-(aminomethyl)-N-decyl-N-methylcycloheptan-1-amine
CID 63481336
4-(aminomethyl)-N-butyl-N-methyloxepan-4-amine
CID 65078991
4-(aminomethyl)-N-butyl-N-methyl-1-propan-2-ylazepan-4-amine
CID 65078409
1-(aminomethyl)-N-butyl-N-methyl-4-propan-2-ylcycloheptan-1-amine
CID 65091297
1-(aminomethyl)-N-butyl-N-methyl-3-propan-2-ylcyclobutan-1-amine
CID 103562532
1-(aminomethyl)-N-butyl-N-methyl-4-phenylcyclohexan-1-amine
CID 29276937
1-(aminomethyl)-N-(3-fluoropropyl)-N-methylcyclopentan-1-amine
CID 81106189
4-(aminomethyl)-N-methyl-N-pentyl-1-propylazepan-4-amine
CID 65078655
1-(aminomethyl)-3-ethyl-N-methyl-N-pentylcyclopentan-1-amine
CID 64500961
1-(aminomethyl)-N-(3-ethylsulfonylpropyl)-N-methylcyclopentan-1-amine
CID 65094131
1-(aminomethyl)-N-methyl-N-pentyl-3-propan-2-ylcyclobutan-1-amine
CID 103562597
N'-[1-(aminomethyl)-4-ethylcyclohexyl]-N,N,N'-trimethylpropane-1,3-diamine
CID 63694995

Frequently Asked Questions

What is the IUPAC name of 1-(aminomethyl)-N-butyl-N-methylcyclopropan-1-amine?
The IUPAC name of 1-(aminomethyl)-N-butyl-N-methylcyclopropan-1-amine (CID 106661013) is 1-(aminomethyl)-N-butyl-N-methylcyclopropan-1-amine.
What is the SMILES notation for 1-(aminomethyl)-N-butyl-N-methylcyclopropan-1-amine?
The canonical SMILES for 1-(aminomethyl)-N-butyl-N-methylcyclopropan-1-amine is CCCCN(C)C1(CN)CC1.
What is the InChIKey of 1-(aminomethyl)-N-butyl-N-methylcyclopropan-1-amine?
The InChIKey is PWUAKCZNWAGQBS-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H20N2/c1-3-4-7-11(2)9(8-10)5-6-9/h3-8,10H2,1-2H3.
What are the key properties of 1-(aminomethyl)-N-butyl-N-methylcyclopropan-1-amine?
1-(aminomethyl)-N-butyl-N-methylcyclopropan-1-amine has a molecular weight of 156.27 g/mol, XLogP of 1.21, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(aminomethyl)-N-butyl-N-methylcyclopropan-1-amine is sourced from PubChem (CID 106661013), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).