N,1,2-trimethyl-N-[(Z)-prop-1-enyl]-3-propylcyclopropan-1-amine

C12H23N — CID 134603664

IUPACN,1,2-trimethyl-N-[(Z)-prop-1-enyl]-3-propylcyclopropan-1-amine
SMILESC/C=C\N(C)C1(C)C(C)C1CCC
InChIInChI=1S/C12H23N/c1-6-8-11-10(3)12(11,4)13(5)9-7-2/h7,9-11H,6,8H2,1-5H3/b9-7-
InChIKeyLRHOBDTTXJZKPP-CLFYSBASSA-N
MW181.32 g/mol
LogP3.28
Rot. Bonds4

About N,1,2-trimethyl-N-[(Z)-prop-1-enyl]-3-propylcyclopropan-1-amine

N,1,2-trimethyl-N-[(Z)-prop-1-enyl]-3-propylcyclopropan-1-amine (PubChem CID 134603664) has the molecular formula C12H23N and a molecular weight of 181.32 g/mol. Its IUPAC name is N,1,2-trimethyl-N-[(Z)-prop-1-enyl]-3-propylcyclopropan-1-amine.

Molecular Properties

Compound NameN,1,2-trimethyl-N-[(Z)-prop-1-enyl]-3-propylcyclopropan-1-amine
PubChem CID134603664
Molecular FormulaC12H23N
Molecular Weight181.32 g/mol
Exact Mass181.18
IUPAC NameN,1,2-trimethyl-N-[(Z)-prop-1-enyl]-3-propylcyclopropan-1-amine
SMILESC/C=C\N(C)C1(C)C(C)C1CCC
InChIInChI=1S/C12H23N/c1-6-8-11-10(3)12(11,4)13(5)9-7-2/h7,9-11H,6,8H2,1-5H3/b9-7-
InChIKeyLRHOBDTTXJZKPP-CLFYSBASSA-N
XLogP3.28
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500181.32
LogP ≤ 53.28
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of N,1,2-trimethyl-N-[(Z)-prop-1-enyl]-3-propylcyclopropan-1-amine?
The IUPAC name of N,1,2-trimethyl-N-[(Z)-prop-1-enyl]-3-propylcyclopropan-1-amine (CID 134603664) is N,1,2-trimethyl-N-[(Z)-prop-1-enyl]-3-propylcyclopropan-1-amine.
What is the SMILES notation for N,1,2-trimethyl-N-[(Z)-prop-1-enyl]-3-propylcyclopropan-1-amine?
The canonical SMILES for N,1,2-trimethyl-N-[(Z)-prop-1-enyl]-3-propylcyclopropan-1-amine is C/C=C\N(C)C1(C)C(C)C1CCC.
What is the InChIKey of N,1,2-trimethyl-N-[(Z)-prop-1-enyl]-3-propylcyclopropan-1-amine?
The InChIKey is LRHOBDTTXJZKPP-CLFYSBASSA-N. The full InChI is InChI=1S/C12H23N/c1-6-8-11-10(3)12(11,4)13(5)9-7-2/h7,9-11H,6,8H2,1-5H3/b9-7-.
What are the key properties of N,1,2-trimethyl-N-[(Z)-prop-1-enyl]-3-propylcyclopropan-1-amine?
N,1,2-trimethyl-N-[(Z)-prop-1-enyl]-3-propylcyclopropan-1-amine has a molecular weight of 181.32 g/mol, XLogP of 3.28, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N,1,2-trimethyl-N-[(Z)-prop-1-enyl]-3-propylcyclopropan-1-amine is sourced from PubChem (CID 134603664), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).