N-methylbicyclo[3.1.1]heptan-2-amine

C8H15N — CID 84647867

IUPACN-methylbicyclo[3.1.1]heptan-2-amine
SMILESCNC1CCC2CC1C2
InChIInChI=1S/C8H15N/c1-9-8-3-2-6-4-7(8)5-6/h6-9H,2-5H2,1H3
InChIKeyQNTWAIAUCURJKU-UHFFFAOYSA-N
MW125.22 g/mol
LogP1.39
Rot. Bonds1

About N-methylbicyclo[3.1.1]heptan-2-amine

N-methylbicyclo[3.1.1]heptan-2-amine (PubChem CID 84647867) has the molecular formula C8H15N and a molecular weight of 125.22 g/mol. Its IUPAC name is N-methylbicyclo[3.1.1]heptan-2-amine.

Molecular Properties

Compound NameN-methylbicyclo[3.1.1]heptan-2-amine
PubChem CID84647867
Molecular FormulaC8H15N
Molecular Weight125.22 g/mol
Exact Mass125.12
IUPAC NameN-methylbicyclo[3.1.1]heptan-2-amine
SMILESCNC1CCC2CC1C2
InChIInChI=1S/C8H15N/c1-9-8-3-2-6-4-7(8)5-6/h6-9H,2-5H2,1H3
InChIKeyQNTWAIAUCURJKU-UHFFFAOYSA-N
XLogP1.39
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500125.22
LogP ≤ 51.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

N-methyltricyclo[8.3.1.13,7]pentadecan-4-amine
CID 155073643
N,7-dimethylbicyclo[3.3.1]nonan-2-amine
CID 88999597
(1S,2R,4R)-N-methylbicyclo[2.2.1]heptan-2-amine;hydrochloride
CID 138991134
1-[(1R,2S,4R)-2-bicyclo[2.2.1]heptanyl]-3-methylthiourea
CID 98080408
3-ethyl-6-(methylamino)bicyclo[3.3.1]nonane-3-carboxamide
CID 144523023
CID 22714977
CID 22714977
2-N-(2-bicyclo[2.2.1]heptanylmethyl)-1-N,2-N,4-trimethylcyclohexane-1,2-diamine
CID 55231832
2-[[2-bicyclo[2.2.1]heptanylmethyl(methyl)amino]methyl]-4-ethyl-N-methylcyclohexan-1-amine
CID 63681524
(1S,4R,5R,8R)-5-(methylamino)bicyclo[6.1.0]nonan-4-ol
CID 125453764
2-(2-bicyclo[2.2.1]heptanylmethoxy)-N-methylcyclohexan-1-amine
CID 102633098
bicyclo[2.2.1]heptan-2-ol;ethane
CID 143739215
N-ethylbicyclo[2.2.1]heptan-2-amine
CID 19957372

Frequently Asked Questions

What is the IUPAC name of N-methylbicyclo[3.1.1]heptan-2-amine?
The IUPAC name of N-methylbicyclo[3.1.1]heptan-2-amine (CID 84647867) is N-methylbicyclo[3.1.1]heptan-2-amine.
What is the SMILES notation for N-methylbicyclo[3.1.1]heptan-2-amine?
The canonical SMILES for N-methylbicyclo[3.1.1]heptan-2-amine is CNC1CCC2CC1C2.
What is the InChIKey of N-methylbicyclo[3.1.1]heptan-2-amine?
The InChIKey is QNTWAIAUCURJKU-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H15N/c1-9-8-3-2-6-4-7(8)5-6/h6-9H,2-5H2,1H3.
What are the key properties of N-methylbicyclo[3.1.1]heptan-2-amine?
N-methylbicyclo[3.1.1]heptan-2-amine has a molecular weight of 125.22 g/mol, XLogP of 1.39, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-methylbicyclo[3.1.1]heptan-2-amine is sourced from PubChem (CID 84647867), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).