3-methyl-3-propan-2-ylcyclohexan-1-amine

C10H21N — CID 19888682

IUPAC3-methyl-3-propan-2-ylcyclohexan-1-amine
SMILESCC(C)C1(C)CCCC(N)C1
InChIInChI=1S/C10H21N/c1-8(2)10(3)6-4-5-9(11)7-10/h8-9H,4-7,11H2,1-3H3
InChIKeyGBQJNVRZCDMMSJ-UHFFFAOYSA-N
MW155.28 g/mol
LogP2.55
Rot. Bonds1

About 3-methyl-3-propan-2-ylcyclohexan-1-amine

3-methyl-3-propan-2-ylcyclohexan-1-amine (PubChem CID 19888682) has the molecular formula C10H21N and a molecular weight of 155.28 g/mol. Its IUPAC name is 3-methyl-3-propan-2-ylcyclohexan-1-amine.

Molecular Properties

Compound Name3-methyl-3-propan-2-ylcyclohexan-1-amine
PubChem CID19888682
Molecular FormulaC10H21N
Molecular Weight155.28 g/mol
Exact Mass155.17
IUPAC Name3-methyl-3-propan-2-ylcyclohexan-1-amine
SMILESCC(C)C1(C)CCCC(N)C1
InChIInChI=1S/C10H21N/c1-8(2)10(3)6-4-5-9(11)7-10/h8-9H,4-7,11H2,1-3H3
InChIKeyGBQJNVRZCDMMSJ-UHFFFAOYSA-N
XLogP2.55
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500155.28
LogP ≤ 52.55
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 3-methyl-3-propan-2-ylcyclohexan-1-amine?
The IUPAC name of 3-methyl-3-propan-2-ylcyclohexan-1-amine (CID 19888682) is 3-methyl-3-propan-2-ylcyclohexan-1-amine.
What is the SMILES notation for 3-methyl-3-propan-2-ylcyclohexan-1-amine?
The canonical SMILES for 3-methyl-3-propan-2-ylcyclohexan-1-amine is CC(C)C1(C)CCCC(N)C1.
What is the InChIKey of 3-methyl-3-propan-2-ylcyclohexan-1-amine?
The InChIKey is GBQJNVRZCDMMSJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H21N/c1-8(2)10(3)6-4-5-9(11)7-10/h8-9H,4-7,11H2,1-3H3.
What are the key properties of 3-methyl-3-propan-2-ylcyclohexan-1-amine?
3-methyl-3-propan-2-ylcyclohexan-1-amine has a molecular weight of 155.28 g/mol, XLogP of 2.55, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methyl-3-propan-2-ylcyclohexan-1-amine is sourced from PubChem (CID 19888682), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).