N-butyl-2,2,3,3-tetramethylcyclopropan-1-amine

C11H23N — CID 79358985

IUPACN-butyl-2,2,3,3-tetramethylcyclopropan-1-amine
SMILESCCCCNC1C(C)(C)C1(C)C
InChIInChI=1S/C11H23N/c1-6-7-8-12-9-10(2,3)11(9,4)5/h9,12H,6-8H2,1-5H3
InChIKeyAVZGWUQTISAROS-UHFFFAOYSA-N
MW169.31 g/mol
LogP2.81
Rot. Bonds4

About N-butyl-2,2,3,3-tetramethylcyclopropan-1-amine

N-butyl-2,2,3,3-tetramethylcyclopropan-1-amine (PubChem CID 79358985) has the molecular formula C11H23N and a molecular weight of 169.31 g/mol. Its IUPAC name is N-butyl-2,2,3,3-tetramethylcyclopropan-1-amine.

Molecular Properties

Compound NameN-butyl-2,2,3,3-tetramethylcyclopropan-1-amine
PubChem CID79358985
Molecular FormulaC11H23N
Molecular Weight169.31 g/mol
Exact Mass169.18
IUPAC NameN-butyl-2,2,3,3-tetramethylcyclopropan-1-amine
SMILESCCCCNC1C(C)(C)C1(C)C
InChIInChI=1S/C11H23N/c1-6-7-8-12-9-10(2,3)11(9,4)5/h9,12H,6-8H2,1-5H3
InChIKeyAVZGWUQTISAROS-UHFFFAOYSA-N
XLogP2.81
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
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-butyl-2,2-dimethylcyclopropan-1-amine
CID 61223200
2,2,3,3-tetramethyl-N-(3-methylbutyl)cyclopropan-1-amine
CID 79353394
2,2-dimethyl-5-[(2,2,3,3-tetramethylcyclopropyl)amino]pentanenitrile
CID 79358554
N-butyl-4,4-dimethylcycloheptan-1-amine
CID 65082955
N,N'-bis(2,2,6,6-tetramethylpiperidin-4-yl)hexane-1,6-diamine;N-butyl-2,2,6,6-tetramethylpiperidin-4-amine
CID 68740612
(1R,2S,3R,4R)-3-(butylamino)-1,7,7-trimethylbicyclo[2.2.1]heptan-2-ol
CID 98129574
3,3,5,5-tetramethyl-N-pentylcyclohexan-1-amine
CID 112681822
N-butyl-N'-cyclopropylpropane-1,3-diamine
CID 61149641
N-butyl-2,2,7,7-tetramethylazepan-4-amine
CID 138568123
N-butyl-1-hydroperoxy-2,2,6,6-tetramethylpiperidin-4-amine
CID 174683339
N-butylcyclohexanamine;molecular hydrogen
CID 143047743
N-butylbutan-1-amine;hydrochloride
CID 3083954

Frequently Asked Questions

What is the IUPAC name of N-butyl-2,2,3,3-tetramethylcyclopropan-1-amine?
The IUPAC name of N-butyl-2,2,3,3-tetramethylcyclopropan-1-amine (CID 79358985) is N-butyl-2,2,3,3-tetramethylcyclopropan-1-amine.
What is the SMILES notation for N-butyl-2,2,3,3-tetramethylcyclopropan-1-amine?
The canonical SMILES for N-butyl-2,2,3,3-tetramethylcyclopropan-1-amine is CCCCNC1C(C)(C)C1(C)C.
What is the InChIKey of N-butyl-2,2,3,3-tetramethylcyclopropan-1-amine?
The InChIKey is AVZGWUQTISAROS-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H23N/c1-6-7-8-12-9-10(2,3)11(9,4)5/h9,12H,6-8H2,1-5H3.
What are the key properties of N-butyl-2,2,3,3-tetramethylcyclopropan-1-amine?
N-butyl-2,2,3,3-tetramethylcyclopropan-1-amine has a molecular weight of 169.31 g/mol, XLogP of 2.81, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-butyl-2,2,3,3-tetramethylcyclopropan-1-amine is sourced from PubChem (CID 79358985), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).