N-(3-cyclopropylpropyl)-2,2-dimethylpropan-1-amine

C11H23N — CID 115639400

IUPACN-(3-cyclopropylpropyl)-2,2-dimethylpropan-1-amine
SMILESCC(C)(C)CNCCCC1CC1
InChIInChI=1S/C11H23N/c1-11(2,3)9-12-8-4-5-10-6-7-10/h10,12H,4-9H2,1-3H3
InChIKeyDFCMDHSBCNMRFL-UHFFFAOYSA-N
MW169.31 g/mol
LogP2.81
Rot. Bonds5

About N-(3-cyclopropylpropyl)-2,2-dimethylpropan-1-amine

N-(3-cyclopropylpropyl)-2,2-dimethylpropan-1-amine (PubChem CID 115639400) has the molecular formula C11H23N and a molecular weight of 169.31 g/mol. Its IUPAC name is N-(3-cyclopropylpropyl)-2,2-dimethylpropan-1-amine.

Molecular Properties

Compound NameN-(3-cyclopropylpropyl)-2,2-dimethylpropan-1-amine
PubChem CID115639400
Molecular FormulaC11H23N
Molecular Weight169.31 g/mol
Exact Mass169.18
IUPAC NameN-(3-cyclopropylpropyl)-2,2-dimethylpropan-1-amine
SMILESCC(C)(C)CNCCCC1CC1
InChIInChI=1S/C11H23N/c1-11(2,3)9-12-8-4-5-10-6-7-10/h10,12H,4-9H2,1-3H3
InChIKeyDFCMDHSBCNMRFL-UHFFFAOYSA-N
XLogP2.81
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500169.31
LogP ≤ 52.81
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

N'-(3-cyclopropylpropyl)-2-(2,2-dimethylpropyl)propane-1,3-diamine
CID 107473665
3-cyclohexyl-N-(2,2,2-trifluoroethyl)propan-1-amine
CID 60998000
4-cyclopropyl-N-propylbutan-1-amine
CID 57222613
N'-(2,2-dimethylpropyl)ethane-1,2-diamine
CID 61168060
2,2-dimethyl-N-[(4-methylcyclohexyl)methyl]propan-1-amine
CID 63001387
N-[(4-tert-butylcyclohexyl)methyl]-2,2-dimethylpropan-1-amine
CID 104574982
N'-[3-(6-cyclopropylhexylamino)propyl]-N-ethylpropane-1,3-diamine
CID 158860052
6-(2,2-dimethylpropylamino)hexan-1-ol
CID 115909001
2,2-dimethyl-N-propylpropan-1-amine
CID 551573
3-(2-cyclopropylethylamino)-2-methylpropane-1,2-diol
CID 66186922
N-(2,2-dimethylpropyl)-N'-propan-2-ylpropane-1,3-diamine
CID 61166306
N-(cycloheptylmethyl)-3-cyclopentylpropan-1-amine
CID 106008062

Frequently Asked Questions

What is the IUPAC name of N-(3-cyclopropylpropyl)-2,2-dimethylpropan-1-amine?
The IUPAC name of N-(3-cyclopropylpropyl)-2,2-dimethylpropan-1-amine (CID 115639400) is N-(3-cyclopropylpropyl)-2,2-dimethylpropan-1-amine.
What is the SMILES notation for N-(3-cyclopropylpropyl)-2,2-dimethylpropan-1-amine?
The canonical SMILES for N-(3-cyclopropylpropyl)-2,2-dimethylpropan-1-amine is CC(C)(C)CNCCCC1CC1.
What is the InChIKey of N-(3-cyclopropylpropyl)-2,2-dimethylpropan-1-amine?
The InChIKey is DFCMDHSBCNMRFL-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H23N/c1-11(2,3)9-12-8-4-5-10-6-7-10/h10,12H,4-9H2,1-3H3.
What are the key properties of N-(3-cyclopropylpropyl)-2,2-dimethylpropan-1-amine?
N-(3-cyclopropylpropyl)-2,2-dimethylpropan-1-amine has a molecular weight of 169.31 g/mol, XLogP of 2.81, 5 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-cyclopropylpropyl)-2,2-dimethylpropan-1-amine is sourced from PubChem (CID 115639400), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).