N-cyclopropyl-2-ethyl-N',2-dimethyl-N'-[(2-methylcyclopropyl)methyl]propane-1,3-diamine

C15H30N2 — CID 63864351

IUPACN-cyclopropyl-2-ethyl-N',2-dimethyl-N'-[(2-methylcyclopropyl)methyl]propane-1,3-diamine
SMILESCCC(C)(CNC1CC1)CN(C)CC1CC1C
InChIInChI=1S/C15H30N2/c1-5-15(3,10-16-14-6-7-14)11-17(4)9-13-8-12(13)2/h12-14,16H,5-11H2,1-4H3
InChIKeyNQCMONXVWYLCRN-UHFFFAOYSA-N
MW238.42 g/mol
LogP2.74
Rot. Bonds8

About N-cyclopropyl-2-ethyl-N',2-dimethyl-N'-[(2-methylcyclopropyl)methyl]propane-1,3-diamine

N-cyclopropyl-2-ethyl-N',2-dimethyl-N'-[(2-methylcyclopropyl)methyl]propane-1,3-diamine (PubChem CID 63864351) has the molecular formula C15H30N2 and a molecular weight of 238.42 g/mol. Its IUPAC name is N-cyclopropyl-2-ethyl-N',2-dimethyl-N'-[(2-methylcyclopropyl)methyl]propane-1,3-diamine.

Molecular Properties

Compound NameN-cyclopropyl-2-ethyl-N',2-dimethyl-N'-[(2-methylcyclopropyl)methyl]propane-1,3-diamine
PubChem CID63864351
Molecular FormulaC15H30N2
Molecular Weight238.42 g/mol
Exact Mass238.24
IUPAC NameN-cyclopropyl-2-ethyl-N',2-dimethyl-N'-[(2-methylcyclopropyl)methyl]propane-1,3-diamine
SMILESCCC(C)(CNC1CC1)CN(C)CC1CC1C
InChIInChI=1S/C15H30N2/c1-5-15(3,10-16-14-6-7-14)11-17(4)9-13-8-12(13)2/h12-14,16H,5-11H2,1-4H3
InChIKeyNQCMONXVWYLCRN-UHFFFAOYSA-N
XLogP2.74
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds8
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.42
LogP ≤ 52.74
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-2-ethyl-N',2-dimethyl-N'-[(2-methylcyclopropyl)methyl]propane-1,3-diamine?
The IUPAC name of N-cyclopropyl-2-ethyl-N',2-dimethyl-N'-[(2-methylcyclopropyl)methyl]propane-1,3-diamine (CID 63864351) is N-cyclopropyl-2-ethyl-N',2-dimethyl-N'-[(2-methylcyclopropyl)methyl]propane-1,3-diamine.
What is the SMILES notation for N-cyclopropyl-2-ethyl-N',2-dimethyl-N'-[(2-methylcyclopropyl)methyl]propane-1,3-diamine?
The canonical SMILES for N-cyclopropyl-2-ethyl-N',2-dimethyl-N'-[(2-methylcyclopropyl)methyl]propane-1,3-diamine is CCC(C)(CNC1CC1)CN(C)CC1CC1C.
What is the InChIKey of N-cyclopropyl-2-ethyl-N',2-dimethyl-N'-[(2-methylcyclopropyl)methyl]propane-1,3-diamine?
The InChIKey is NQCMONXVWYLCRN-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H30N2/c1-5-15(3,10-16-14-6-7-14)11-17(4)9-13-8-12(13)2/h12-14,16H,5-11H2,1-4H3.
What are the key properties of N-cyclopropyl-2-ethyl-N',2-dimethyl-N'-[(2-methylcyclopropyl)methyl]propane-1,3-diamine?
N-cyclopropyl-2-ethyl-N',2-dimethyl-N'-[(2-methylcyclopropyl)methyl]propane-1,3-diamine has a molecular weight of 238.42 g/mol, XLogP of 2.74, 8 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-2-ethyl-N',2-dimethyl-N'-[(2-methylcyclopropyl)methyl]propane-1,3-diamine is sourced from PubChem (CID 63864351), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).