N-(2,2-dicyclopropylethyl)propan-1-amine

C11H21N — CID 19374902

IUPACN-(2,2-dicyclopropylethyl)propan-1-amine
SMILESCCCNCC(C1CC1)C1CC1
InChIInChI=1S/C11H21N/c1-2-7-12-8-11(9-3-4-9)10-5-6-10/h9-12H,2-8H2,1H3
InChIKeyMBXPGADABCBPFE-UHFFFAOYSA-N
MW167.30 g/mol
LogP2.42
Rot. Bonds6

About N-(2,2-dicyclopropylethyl)propan-1-amine

N-(2,2-dicyclopropylethyl)propan-1-amine (PubChem CID 19374902) has the molecular formula C11H21N and a molecular weight of 167.30 g/mol. Its IUPAC name is N-(2,2-dicyclopropylethyl)propan-1-amine.

Molecular Properties

Compound NameN-(2,2-dicyclopropylethyl)propan-1-amine
PubChem CID19374902
Molecular FormulaC11H21N
Molecular Weight167.30 g/mol
Exact Mass167.17
IUPAC NameN-(2,2-dicyclopropylethyl)propan-1-amine
SMILESCCCNCC(C1CC1)C1CC1
InChIInChI=1S/C11H21N/c1-2-7-12-8-11(9-3-4-9)10-5-6-10/h9-12H,2-8H2,1H3
InChIKeyMBXPGADABCBPFE-UHFFFAOYSA-N
XLogP2.42
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds6
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500167.30
LogP ≤ 52.42
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

2-cyclopropyl-4-methyl-N-propylpentan-1-amine
CID 104819242
2-cyclohexyl-N-propylpentan-1-amine
CID 82932453
2-cyclopentyl-3,3-dimethyl-N-propylbutan-1-amine
CID 83139413
N-[2-(2,2-dicyclopropylethylamino)ethyl]acetamide
CID 107529576
2,2-dicyclopropyl-N-[2-[2-(2-methoxyethoxy)ethoxy]ethyl]ethanamine
CID 104562462
2-cyclopentyl-N-propylundecan-1-amine
CID 115926613
2-cyclopentyl-N-propyl-3-trimethylsilylpropan-1-amine
CID 106323935
2-cyclopentyl-N-propyldecan-1-amine
CID 112569910
2-cyclopentyl-5,5-dimethyl-N-propylhexan-1-amine
CID 112569928
N-[2-(2-aminoethoxy)ethyl]-2,2-dicyclopropylethanamine
CID 79479050
2-methyl-3-(4-methylcyclohexyl)-N-propylpropan-1-amine
CID 64776338
2-cyclopentyl-4-methyl-N-propylheptan-1-amine
CID 112569912

Frequently Asked Questions

What is the IUPAC name of N-(2,2-dicyclopropylethyl)propan-1-amine?
The IUPAC name of N-(2,2-dicyclopropylethyl)propan-1-amine (CID 19374902) is N-(2,2-dicyclopropylethyl)propan-1-amine.
What is the SMILES notation for N-(2,2-dicyclopropylethyl)propan-1-amine?
The canonical SMILES for N-(2,2-dicyclopropylethyl)propan-1-amine is CCCNCC(C1CC1)C1CC1.
What is the InChIKey of N-(2,2-dicyclopropylethyl)propan-1-amine?
The InChIKey is MBXPGADABCBPFE-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H21N/c1-2-7-12-8-11(9-3-4-9)10-5-6-10/h9-12H,2-8H2,1H3.
What are the key properties of N-(2,2-dicyclopropylethyl)propan-1-amine?
N-(2,2-dicyclopropylethyl)propan-1-amine has a molecular weight of 167.30 g/mol, XLogP of 2.42, 6 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,2-dicyclopropylethyl)propan-1-amine is sourced from PubChem (CID 19374902), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).