N-cyclopropyl-N,N'-diethyl-2-methyl-2-phenylpropane-1,3-diamine

C17H28N2 — CID 62261792

IUPACN-cyclopropyl-N,N'-diethyl-2-methyl-2-phenylpropane-1,3-diamine
SMILESCCNCC(C)(CN(CC)C1CC1)c1ccccc1
InChIInChI=1S/C17H28N2/c1-4-18-13-17(3,15-9-7-6-8-10-15)14-19(5-2)16-11-12-16/h6-10,16,18H,4-5,11-14H2,1-3H3
InChIKeyVSZOGDXGPNCLRY-UHFFFAOYSA-N
MW260.43 g/mol
LogP3.04
Rot. Bonds8

About N-cyclopropyl-N,N'-diethyl-2-methyl-2-phenylpropane-1,3-diamine

N-cyclopropyl-N,N'-diethyl-2-methyl-2-phenylpropane-1,3-diamine (PubChem CID 62261792) has the molecular formula C17H28N2 and a molecular weight of 260.43 g/mol. Its IUPAC name is N-cyclopropyl-N,N'-diethyl-2-methyl-2-phenylpropane-1,3-diamine.

Molecular Properties

Compound NameN-cyclopropyl-N,N'-diethyl-2-methyl-2-phenylpropane-1,3-diamine
PubChem CID62261792
Molecular FormulaC17H28N2
Molecular Weight260.43 g/mol
Exact Mass260.23
IUPAC NameN-cyclopropyl-N,N'-diethyl-2-methyl-2-phenylpropane-1,3-diamine
SMILESCCNCC(C)(CN(CC)C1CC1)c1ccccc1
InChIInChI=1S/C17H28N2/c1-4-18-13-17(3,15-9-7-6-8-10-15)14-19(5-2)16-11-12-16/h6-10,16,18H,4-5,11-14H2,1-3H3
InChIKeyVSZOGDXGPNCLRY-UHFFFAOYSA-N
XLogP3.04
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds8
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.43
LogP ≤ 53.04
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-[cyclobutyl-[3-(ethylamino)-2-methyl-2-phenylpropyl]amino]ethanol
CID 102871059
N-(cyclopentylmethyl)-N'-ethyl-N,2-dimethyl-2-phenylpropane-1,3-diamine
CID 63631647
N,N'-diethyl-2-methyl-2-phenyl-N'-propylpropane-1,3-diamine
CID 62262898
N,N'-diethyl-2-methyl-2-phenyl-N'-propan-2-ylpropane-1,3-diamine
CID 62261442
1-[ethyl-[3-(ethylamino)-2-methyl-2-phenylpropyl]amino]-2-methylpropan-2-ol
CID 79377198
N-ethyl-N',2-dimethyl-2-phenyl-N'-(2,2,2-trifluoroethyl)propane-1,3-diamine
CID 62256339
2-[cyclopropyl-[2-methyl-3-(methylamino)-2-phenylpropyl]amino]ethanol
CID 55056120
N-cyclopropyl-N',2-dimethyl-N-(3-methylbutyl)-2-phenylpropane-1,3-diamine
CID 78987346
N-(cyclopropylmethyl)-N-ethyl-2-methyl-2-phenyl-N'-propylpropane-1,3-diamine
CID 63954461
N-cyclopropyl-N'-ethyl-N',2-dimethyl-2-phenylpropane-1,3-diamine
CID 62262722
N-cyclopropyl-N,2-dimethyl-2-phenyl-N'-propan-2-ylpropane-1,3-diamine
CID 62262364
3-(azocan-1-yl)-N-ethyl-2-methyl-2-phenylpropan-1-amine
CID 62262873

Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-N,N'-diethyl-2-methyl-2-phenylpropane-1,3-diamine?
The IUPAC name of N-cyclopropyl-N,N'-diethyl-2-methyl-2-phenylpropane-1,3-diamine (CID 62261792) is N-cyclopropyl-N,N'-diethyl-2-methyl-2-phenylpropane-1,3-diamine.
What is the SMILES notation for N-cyclopropyl-N,N'-diethyl-2-methyl-2-phenylpropane-1,3-diamine?
The canonical SMILES for N-cyclopropyl-N,N'-diethyl-2-methyl-2-phenylpropane-1,3-diamine is CCNCC(C)(CN(CC)C1CC1)c1ccccc1.
What is the InChIKey of N-cyclopropyl-N,N'-diethyl-2-methyl-2-phenylpropane-1,3-diamine?
The InChIKey is VSZOGDXGPNCLRY-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H28N2/c1-4-18-13-17(3,15-9-7-6-8-10-15)14-19(5-2)16-11-12-16/h6-10,16,18H,4-5,11-14H2,1-3H3.
What are the key properties of N-cyclopropyl-N,N'-diethyl-2-methyl-2-phenylpropane-1,3-diamine?
N-cyclopropyl-N,N'-diethyl-2-methyl-2-phenylpropane-1,3-diamine has a molecular weight of 260.43 g/mol, XLogP of 3.04, 8 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-N,N'-diethyl-2-methyl-2-phenylpropane-1,3-diamine is sourced from PubChem (CID 62261792), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).