(1R)-1,7,7-trimethyl-N-propan-2-ylbicyclo[2.2.1]heptan-2-amine

C13H25N — CID 103894720

IUPAC(1R)-1,7,7-trimethyl-N-propan-2-ylbicyclo[2.2.1]heptan-2-amine
SMILESCC(C)NC1CC2CC[C@]1(C)C2(C)C
InChIInChI=1S/C13H25N/c1-9(2)14-11-8-10-6-7-13(11,5)12(10,3)4/h9-11,14H,6-8H2,1-5H3/t10?,11?,13-/m0/s1
InChIKeyKVRZYRDPADWRAG-XIVSLSHWSA-N
MW195.35 g/mol
LogP3.20
Rot. Bonds2

About (1R)-1,7,7-trimethyl-N-propan-2-ylbicyclo[2.2.1]heptan-2-amine

(1R)-1,7,7-trimethyl-N-propan-2-ylbicyclo[2.2.1]heptan-2-amine (PubChem CID 103894720) has the molecular formula C13H25N and a molecular weight of 195.35 g/mol. Its IUPAC name is (1R)-1,7,7-trimethyl-N-propan-2-ylbicyclo[2.2.1]heptan-2-amine.

Molecular Properties

Compound Name(1R)-1,7,7-trimethyl-N-propan-2-ylbicyclo[2.2.1]heptan-2-amine
PubChem CID103894720
Molecular FormulaC13H25N
Molecular Weight195.35 g/mol
Exact Mass195.20
IUPAC Name(1R)-1,7,7-trimethyl-N-propan-2-ylbicyclo[2.2.1]heptan-2-amine
SMILESCC(C)NC1CC2CC[C@]1(C)C2(C)C
InChIInChI=1S/C13H25N/c1-9(2)14-11-8-10-6-7-13(11,5)12(10,3)4/h9-11,14H,6-8H2,1-5H3/t10?,11?,13-/m0/s1
InChIKeyKVRZYRDPADWRAG-XIVSLSHWSA-N
XLogP3.20
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500195.35
LogP ≤ 53.20
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

(2R)-2-[(1,7,7-trimethyl-2-bicyclo[2.2.1]heptanyl)amino]propan-1-ol
CID 114986971
methyl (2S)-2-[(1,7,7-trimethyl-2-bicyclo[2.2.1]heptanyl)amino]propanoate
CID 63021775
2-[[(1S,4S)-1,7,7-trimethyl-2-bicyclo[2.2.1]heptanyl]amino]propane-1,3-diol
CID 103952078
N-heptan-4-yl-1,7,7-trimethylbicyclo[2.2.1]heptan-2-amine
CID 43683810
1,7,7-trimethyl-N-(1-piperidin-1-ylpropan-2-yl)bicyclo[2.2.1]heptan-2-amine
CID 63450726
N-propyl-2-[(1,7,7-trimethyl-2-bicyclo[2.2.1]heptanyl)amino]propanamide
CID 60664094
N-heptan-2-yl-1,7,7-trimethylbicyclo[2.2.1]heptan-2-amine
CID 43222947
1,7,7-trimethyl-N-[1-(oxolan-3-yl)ethyl]bicyclo[2.2.1]heptan-2-amine
CID 113259887
(1R,4R)-N-cyclopropyl-1,7,7-trimethylbicyclo[2.2.1]heptan-2-amine
CID 55278790
1,7,7-trimethyl-N-(1-thiophen-2-ylethyl)bicyclo[2.2.1]heptan-2-amine
CID 43223472
(1S,2R,4S)-N-ethyl-1,7,7-trimethylbicyclo[2.2.1]heptan-2-amine
CID 101269305
N-[1-(4-methoxyphenyl)ethyl]-1,7,7-trimethylbicyclo[2.2.1]heptan-2-amine
CID 43683824

Frequently Asked Questions

What is the IUPAC name of (1R)-1,7,7-trimethyl-N-propan-2-ylbicyclo[2.2.1]heptan-2-amine?
The IUPAC name of (1R)-1,7,7-trimethyl-N-propan-2-ylbicyclo[2.2.1]heptan-2-amine (CID 103894720) is (1R)-1,7,7-trimethyl-N-propan-2-ylbicyclo[2.2.1]heptan-2-amine.
What is the SMILES notation for (1R)-1,7,7-trimethyl-N-propan-2-ylbicyclo[2.2.1]heptan-2-amine?
The canonical SMILES for (1R)-1,7,7-trimethyl-N-propan-2-ylbicyclo[2.2.1]heptan-2-amine is CC(C)NC1CC2CC[C@]1(C)C2(C)C.
What is the InChIKey of (1R)-1,7,7-trimethyl-N-propan-2-ylbicyclo[2.2.1]heptan-2-amine?
The InChIKey is KVRZYRDPADWRAG-XIVSLSHWSA-N. The full InChI is InChI=1S/C13H25N/c1-9(2)14-11-8-10-6-7-13(11,5)12(10,3)4/h9-11,14H,6-8H2,1-5H3/t10?,11?,13-/m0/s1.
What are the key properties of (1R)-1,7,7-trimethyl-N-propan-2-ylbicyclo[2.2.1]heptan-2-amine?
(1R)-1,7,7-trimethyl-N-propan-2-ylbicyclo[2.2.1]heptan-2-amine has a molecular weight of 195.35 g/mol, XLogP of 3.20, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (1R)-1,7,7-trimethyl-N-propan-2-ylbicyclo[2.2.1]heptan-2-amine is sourced from PubChem (CID 103894720), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).