(E)-N-tert-butyl-N,2-dimethylbut-1-en-1-amine

C10H21N — CID 156542407

IUPAC(E)-N-tert-butyl-N,2-dimethylbut-1-en-1-amine
SMILESCC/C(C)=C/N(C)C(C)(C)C
InChIInChI=1S/C10H21N/c1-7-9(2)8-11(6)10(3,4)5/h8H,7H2,1-6H3/b9-8+
InChIKeyPXGSKRSEPVRCEB-CMDGGOBGSA-N
MW155.28 g/mol
LogP3.03
Rot. Bonds2

About (E)-N-tert-butyl-N,2-dimethylbut-1-en-1-amine

(E)-N-tert-butyl-N,2-dimethylbut-1-en-1-amine (PubChem CID 156542407) has the molecular formula C10H21N and a molecular weight of 155.28 g/mol. Its IUPAC name is (E)-N-tert-butyl-N,2-dimethylbut-1-en-1-amine.

Molecular Properties

Compound Name(E)-N-tert-butyl-N,2-dimethylbut-1-en-1-amine
PubChem CID156542407
Molecular FormulaC10H21N
Molecular Weight155.28 g/mol
Exact Mass155.17
IUPAC Name(E)-N-tert-butyl-N,2-dimethylbut-1-en-1-amine
SMILESCC/C(C)=C/N(C)C(C)(C)C
InChIInChI=1S/C10H21N/c1-7-9(2)8-11(6)10(3,4)5/h8H,7H2,1-6H3/b9-8+
InChIKeyPXGSKRSEPVRCEB-CMDGGOBGSA-N
XLogP3.03
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500155.28
LogP ≤ 53.03
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

2-ethyl-N,N-dimethylbut-1-en-1-amine
CID 101374933
(Z)-N,N,2-trimethylbut-1-en-1-amine
CID 12816149
1-Diethylamino-2-methyl-1-pentene
CID 129663481
(Z)-N,N,2-trimethylhex-1-en-1-amine
CID 134875029
Lithium tert-butyl(2-methylprop-1-enyl)azanide
CID 134889670
2-methyl-N,N-bis(2-methylprop-1-enyl)prop-1-en-1-amine
CID 20138684
N,2-dimethyl-N-(2-methylprop-1-enyl)prop-1-en-1-amine
CID 23150833
N,N,2-trimethylbut-1-en-1-amine
CID 85897045
(1Z)-N-tert-butyl-2,3-dimethyl-N-prop-1-en-2-ylbuta-1,3-dien-1-amine
CID 87058010
(E)-N,N,2,3,3-pentamethylbut-1-en-1-amine
CID 87104234
(E)-N,N,2-trimethylhex-1-en-1-amine
CID 88206407
N,N,2,3-tetramethylbut-1-en-1-amine
CID 91272568

Frequently Asked Questions

What is the IUPAC name of (E)-N-tert-butyl-N,2-dimethylbut-1-en-1-amine?
The IUPAC name of (E)-N-tert-butyl-N,2-dimethylbut-1-en-1-amine (CID 156542407) is (E)-N-tert-butyl-N,2-dimethylbut-1-en-1-amine.
What is the SMILES notation for (E)-N-tert-butyl-N,2-dimethylbut-1-en-1-amine?
The canonical SMILES for (E)-N-tert-butyl-N,2-dimethylbut-1-en-1-amine is CC/C(C)=C/N(C)C(C)(C)C.
What is the InChIKey of (E)-N-tert-butyl-N,2-dimethylbut-1-en-1-amine?
The InChIKey is PXGSKRSEPVRCEB-CMDGGOBGSA-N. The full InChI is InChI=1S/C10H21N/c1-7-9(2)8-11(6)10(3,4)5/h8H,7H2,1-6H3/b9-8+.
What are the key properties of (E)-N-tert-butyl-N,2-dimethylbut-1-en-1-amine?
(E)-N-tert-butyl-N,2-dimethylbut-1-en-1-amine has a molecular weight of 155.28 g/mol, XLogP of 3.03, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (E)-N-tert-butyl-N,2-dimethylbut-1-en-1-amine is sourced from PubChem (CID 156542407), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).