4-tert-butyl-5-methylcyclononan-1-amine

C14H29N — CID 175635509

IUPAC4-tert-butyl-5-methylcyclononan-1-amine
SMILESCC1CCCCC(N)CCC1C(C)(C)C
InChIInChI=1S/C14H29N/c1-11-7-5-6-8-12(15)9-10-13(11)14(2,3)4/h11-13H,5-10,15H2,1-4H3
InChIKeyLMTRNXBVDFSGIV-UHFFFAOYSA-N
MW211.39 g/mol
LogP3.97
Rot. Bonds

About 4-tert-butyl-5-methylcyclononan-1-amine

4-tert-butyl-5-methylcyclononan-1-amine (PubChem CID 175635509) has the molecular formula C14H29N and a molecular weight of 211.39 g/mol. Its IUPAC name is 4-tert-butyl-5-methylcyclononan-1-amine.

Molecular Properties

Compound Name4-tert-butyl-5-methylcyclononan-1-amine
PubChem CID175635509
Molecular FormulaC14H29N
Molecular Weight211.39 g/mol
Exact Mass211.23
IUPAC Name4-tert-butyl-5-methylcyclononan-1-amine
SMILESCC1CCCCC(N)CCC1C(C)(C)C
InChIInChI=1S/C14H29N/c1-11-7-5-6-8-12(15)9-10-13(11)14(2,3)4/h11-13H,5-10,15H2,1-4H3
InChIKeyLMTRNXBVDFSGIV-UHFFFAOYSA-N
XLogP3.97
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500211.39
LogP ≤ 53.97
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

5-tert-butyl-4-methylcyclooctan-1-amine
CID 175635893
trans-(1R,2R)-1-tert-butyl-2-methylcyclohexane
CID 102398260
(1R)-1-tert-butyl-2-methylcyclopentane
CID 59875251
azane;cyclopentanamine
CID 69254255
CID 175698442
CID 175698442
cyclopentanamine;platinum(2+)
CID 21144800
2-tert-butylcyclohexan-1-amine;methane
CID 158774532
4-tert-butyl-3-cyclopropylcyclohexan-1-amine
CID 165498686
5-methylcyclododecan-1-amine
CID 138488786
N-[(4-aminocyclohexyl)methyl]-N,2-dimethylcyclohexan-1-amine
CID 55004478
cis-(1R,2S)-1,2-dimethylcyclohexane;methanamine
CID 142167756
azane;cycloheptanamine
CID 135353953

Frequently Asked Questions

What is the IUPAC name of 4-tert-butyl-5-methylcyclononan-1-amine?
The IUPAC name of 4-tert-butyl-5-methylcyclononan-1-amine (CID 175635509) is 4-tert-butyl-5-methylcyclononan-1-amine.
What is the SMILES notation for 4-tert-butyl-5-methylcyclononan-1-amine?
The canonical SMILES for 4-tert-butyl-5-methylcyclononan-1-amine is CC1CCCCC(N)CCC1C(C)(C)C.
What is the InChIKey of 4-tert-butyl-5-methylcyclononan-1-amine?
The InChIKey is LMTRNXBVDFSGIV-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H29N/c1-11-7-5-6-8-12(15)9-10-13(11)14(2,3)4/h11-13H,5-10,15H2,1-4H3.
What are the key properties of 4-tert-butyl-5-methylcyclononan-1-amine?
4-tert-butyl-5-methylcyclononan-1-amine has a molecular weight of 211.39 g/mol, XLogP of 3.97, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-tert-butyl-5-methylcyclononan-1-amine is sourced from PubChem (CID 175635509), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).