1-[2-(2-bicyclo[2.2.1]heptanylmethyl)cyclobutyl]-N-methylmethanamine

C14H25N — CID 81017377

IUPAC1-[2-(2-bicyclo[2.2.1]heptanylmethyl)cyclobutyl]-N-methylmethanamine
SMILESCNCC1CCC1CC1CC2CCC1C2
InChIInChI=1S/C14H25N/c1-15-9-13-5-4-12(13)8-14-7-10-2-3-11(14)6-10/h10-15H,2-9H2,1H3
InChIKeyNMASPCRLPVKFSN-UHFFFAOYSA-N
MW207.36 g/mol
LogP3.06
Rot. Bonds4

About 1-[2-(2-bicyclo[2.2.1]heptanylmethyl)cyclobutyl]-N-methylmethanamine

1-[2-(2-bicyclo[2.2.1]heptanylmethyl)cyclobutyl]-N-methylmethanamine (PubChem CID 81017377) has the molecular formula C14H25N and a molecular weight of 207.36 g/mol. Its IUPAC name is 1-[2-(2-bicyclo[2.2.1]heptanylmethyl)cyclobutyl]-N-methylmethanamine.

Molecular Properties

Compound Name1-[2-(2-bicyclo[2.2.1]heptanylmethyl)cyclobutyl]-N-methylmethanamine
PubChem CID81017377
Molecular FormulaC14H25N
Molecular Weight207.36 g/mol
Exact Mass207.20
IUPAC Name1-[2-(2-bicyclo[2.2.1]heptanylmethyl)cyclobutyl]-N-methylmethanamine
SMILESCNCC1CCC1CC1CC2CCC1C2
InChIInChI=1S/C14H25N/c1-15-9-13-5-4-12(13)8-14-7-10-2-3-11(14)6-10/h10-15H,2-9H2,1H3
InChIKeyNMASPCRLPVKFSN-UHFFFAOYSA-N
XLogP3.06
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500207.36
LogP ≤ 53.06
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

N-[[2-(2-bicyclo[2.2.1]heptanylmethyl)-4-propan-2-ylcyclohexyl]methyl]ethanamine
CID 81026249
2-[(3-chloro-2-methylcyclopentyl)methyl]bicyclo[2.2.1]heptane
CID 79550624
1-[1-(2-bicyclo[2.2.1]heptanylmethyl)piperidin-4-yl]-N-methylmethanamine
CID 79552323
(1S,2S,4R)-2-ethylbicyclo[2.2.1]heptane
CID 124524751
(1S,2S,4R)-2-[2-[(1R,2S,4S)-2-bicyclo[2.2.1]heptanyl]ethyl]bicyclo[2.2.1]heptane
CID 54589598
2-ethylbicyclo[2.2.1]heptane;methane
CID 169189353
trans-(1R,2R)-N-(2-bicyclo[2.2.1]heptanylmethyl)-2-methylcyclopropan-1-amine
CID 130978957
(1R,2S,4R)-2-(iodomethyl)bicyclo[2.2.1]heptane
CID 98085317
5-(2-bicyclo[2.2.1]heptanyl)-N-methylpent-3-en-1-amine
CID 79590034
2-(2-bicyclo[2.2.1]heptanylmethyl)-1-methyl-1,2,3,3a,4,5,6,6a-octahydropentalene
CID 19102351
(2S)-2-propylbicyclo[2.2.1]heptane
CID 143719109
1-[2-(2-bicyclo[2.2.1]heptanyl)-4,4-dimethylcyclohexyl]-N-methylmethanamine
CID 114247026

Frequently Asked Questions

What is the IUPAC name of 1-[2-(2-bicyclo[2.2.1]heptanylmethyl)cyclobutyl]-N-methylmethanamine?
The IUPAC name of 1-[2-(2-bicyclo[2.2.1]heptanylmethyl)cyclobutyl]-N-methylmethanamine (CID 81017377) is 1-[2-(2-bicyclo[2.2.1]heptanylmethyl)cyclobutyl]-N-methylmethanamine.
What is the SMILES notation for 1-[2-(2-bicyclo[2.2.1]heptanylmethyl)cyclobutyl]-N-methylmethanamine?
The canonical SMILES for 1-[2-(2-bicyclo[2.2.1]heptanylmethyl)cyclobutyl]-N-methylmethanamine is CNCC1CCC1CC1CC2CCC1C2.
What is the InChIKey of 1-[2-(2-bicyclo[2.2.1]heptanylmethyl)cyclobutyl]-N-methylmethanamine?
The InChIKey is NMASPCRLPVKFSN-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H25N/c1-15-9-13-5-4-12(13)8-14-7-10-2-3-11(14)6-10/h10-15H,2-9H2,1H3.
What are the key properties of 1-[2-(2-bicyclo[2.2.1]heptanylmethyl)cyclobutyl]-N-methylmethanamine?
1-[2-(2-bicyclo[2.2.1]heptanylmethyl)cyclobutyl]-N-methylmethanamine has a molecular weight of 207.36 g/mol, XLogP of 3.06, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-(2-bicyclo[2.2.1]heptanylmethyl)cyclobutyl]-N-methylmethanamine is sourced from PubChem (CID 81017377), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).