(1R,2S,6S,7S,8S)-N-(cyclopropylmethyl)tricyclo[5.2.1.02,6]decan-8-amine

C14H23N — CID 98119188

IUPAC(1R,2S,6S,7S,8S)-N-(cyclopropylmethyl)tricyclo[5.2.1.02,6]decan-8-amine
SMILESC1C[C@H]2[C@@H](C1)[C@@H]1C[C@@H]2[C@@H](NCC2CC2)C1
InChIInChI=1S/C14H23N/c1-2-11-10-6-13(12(11)3-1)14(7-10)15-8-9-4-5-9/h9-15H,1-8H2/t10-,11+,12+,13+,14+/m1/s1
InChIKeyCZZINEFQJRAPBJ-QMVSFRDZSA-N
MW205.34 g/mol
LogP2.81
Rot. Bonds3

About (1R,2S,6S,7S,8S)-N-(cyclopropylmethyl)tricyclo[5.2.1.02,6]decan-8-amine

(1R,2S,6S,7S,8S)-N-(cyclopropylmethyl)tricyclo[5.2.1.02,6]decan-8-amine (PubChem CID 98119188) has the molecular formula C14H23N and a molecular weight of 205.34 g/mol. Its IUPAC name is (1R,2S,6S,7S,8S)-N-(cyclopropylmethyl)tricyclo[5.2.1.02,6]decan-8-amine.

Molecular Properties

Compound Name(1R,2S,6S,7S,8S)-N-(cyclopropylmethyl)tricyclo[5.2.1.02,6]decan-8-amine
PubChem CID98119188
Molecular FormulaC14H23N
Molecular Weight205.34 g/mol
Exact Mass205.18
IUPAC Name(1R,2S,6S,7S,8S)-N-(cyclopropylmethyl)tricyclo[5.2.1.02,6]decan-8-amine
SMILESC1C[C@H]2[C@@H](C1)[C@@H]1C[C@@H]2[C@@H](NCC2CC2)C1
InChIInChI=1S/C14H23N/c1-2-11-10-6-13(12(11)3-1)14(7-10)15-8-9-4-5-9/h9-15H,1-8H2/t10-,11+,12+,13+,14+/m1/s1
InChIKeyCZZINEFQJRAPBJ-QMVSFRDZSA-N
XLogP2.81
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500205.34
LogP ≤ 52.81
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Analyze (1R,2S,6S,7S,8S)-N-(cyclopropylmethyl)tricyclo[5.2.1.02,6]decan-8-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-[(2,2-dimethylcyclopropyl)methyl]tricyclo[5.2.1.02,6]decan-8-amine
CID 114107677
(1R,2S,6R,7S,8R)-N-propyltricyclo[5.2.1.02,6]decan-8-amine
CID 124708771
(1R,2S,6S,7S,8R)-N-(3-methoxypropyl)tricyclo[5.2.1.02,6]decan-8-amine
CID 124708804
(1S,2S,6R,7R,8S)-N-(2-ethylsulfonylethyl)tricyclo[5.2.1.02,6]decan-8-amine
CID 99851077
N-(4-methylsulfanylbutyl)tricyclo[5.2.1.02,6]decan-8-amine
CID 115886378
2-methyl-3-(8-tricyclo[5.2.1.02,6]decanylamino)propanenitrile
CID 62648141
N-[(4-methoxyphenyl)methyl]tricyclo[5.2.1.02,6]decan-8-amine
CID 43392190
N-[(4,5-dimethyl-1,3-oxazol-2-yl)methyl]tricyclo[5.2.1.02,6]decan-8-amine
CID 102673271
(1S,2R,6S,7R,8S)-N-[3-[(S)-methylsulfinyl]propyl]tricyclo[5.2.1.02,6]decan-8-amine
CID 98568433
(1S,2R,6S,7R,8S)-N-[3-[(R)-methylsulfinyl]propyl]tricyclo[5.2.1.02,6]decan-8-amine
CID 98568432
(1S,2R,6S,7R,8R)-N-[3-[(S)-methylsulfinyl]propyl]tricyclo[5.2.1.02,6]decan-8-amine
CID 98568431
N-(3-methylsulfanylbutyl)tricyclo[5.2.1.02,6]decan-8-amine
CID 115886299

Frequently Asked Questions

What is the IUPAC name of (1R,2S,6S,7S,8S)-N-(cyclopropylmethyl)tricyclo[5.2.1.02,6]decan-8-amine?
The IUPAC name of (1R,2S,6S,7S,8S)-N-(cyclopropylmethyl)tricyclo[5.2.1.02,6]decan-8-amine (CID 98119188) is (1R,2S,6S,7S,8S)-N-(cyclopropylmethyl)tricyclo[5.2.1.02,6]decan-8-amine.
What is the SMILES notation for (1R,2S,6S,7S,8S)-N-(cyclopropylmethyl)tricyclo[5.2.1.02,6]decan-8-amine?
The canonical SMILES for (1R,2S,6S,7S,8S)-N-(cyclopropylmethyl)tricyclo[5.2.1.02,6]decan-8-amine is C1C[C@H]2[C@@H](C1)[C@@H]1C[C@@H]2[C@@H](NCC2CC2)C1.
What is the InChIKey of (1R,2S,6S,7S,8S)-N-(cyclopropylmethyl)tricyclo[5.2.1.02,6]decan-8-amine?
The InChIKey is CZZINEFQJRAPBJ-QMVSFRDZSA-N. The full InChI is InChI=1S/C14H23N/c1-2-11-10-6-13(12(11)3-1)14(7-10)15-8-9-4-5-9/h9-15H,1-8H2/t10-,11+,12+,13+,14+/m1/s1.
What are the key properties of (1R,2S,6S,7S,8S)-N-(cyclopropylmethyl)tricyclo[5.2.1.02,6]decan-8-amine?
(1R,2S,6S,7S,8S)-N-(cyclopropylmethyl)tricyclo[5.2.1.02,6]decan-8-amine has a molecular weight of 205.34 g/mol, XLogP of 2.81, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (1R,2S,6S,7S,8S)-N-(cyclopropylmethyl)tricyclo[5.2.1.02,6]decan-8-amine is sourced from PubChem (CID 98119188), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).