N-cyclopropyl-N-(cyclopropylmethyl)-N'-ethyl-2-methylpropane-1,3-diamine

C13H26N2 — CID 64520179

IUPACN-cyclopropyl-N-(cyclopropylmethyl)-N'-ethyl-2-methylpropane-1,3-diamine
SMILESCCNCC(C)CN(CC1CC1)C1CC1
InChIInChI=1S/C13H26N2/c1-3-14-8-11(2)9-15(13-6-7-13)10-12-4-5-12/h11-14H,3-10H2,1-2H3
InChIKeyYGBFCISDDQNDAD-UHFFFAOYSA-N
MW210.36 g/mol
LogP2.11
Rot. Bonds8

About N-cyclopropyl-N-(cyclopropylmethyl)-N'-ethyl-2-methylpropane-1,3-diamine

N-cyclopropyl-N-(cyclopropylmethyl)-N'-ethyl-2-methylpropane-1,3-diamine (PubChem CID 64520179) has the molecular formula C13H26N2 and a molecular weight of 210.36 g/mol. Its IUPAC name is N-cyclopropyl-N-(cyclopropylmethyl)-N'-ethyl-2-methylpropane-1,3-diamine.

Molecular Properties

Compound NameN-cyclopropyl-N-(cyclopropylmethyl)-N'-ethyl-2-methylpropane-1,3-diamine
PubChem CID64520179
Molecular FormulaC13H26N2
Molecular Weight210.36 g/mol
Exact Mass210.21
IUPAC NameN-cyclopropyl-N-(cyclopropylmethyl)-N'-ethyl-2-methylpropane-1,3-diamine
SMILESCCNCC(C)CN(CC1CC1)C1CC1
InChIInChI=1S/C13H26N2/c1-3-14-8-11(2)9-15(13-6-7-13)10-12-4-5-12/h11-14H,3-10H2,1-2H3
InChIKeyYGBFCISDDQNDAD-UHFFFAOYSA-N
XLogP2.11
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds8
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.36
LogP ≤ 52.11
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-(cyclohexylmethyl)-N'-ethyl-N,2-dimethylpropane-1,3-diamine
CID 62413248
N-(3-chloro-2-methylpropyl)-N-(cyclopropylmethyl)cyclopropanamine
CID 64522017
3-N-cyclopropyl-3-N-(cyclopropylmethyl)-1-N-ethyl-2-methylbutane-1,3-diamine
CID 81019609
1-N-cyclopropyl-1-N-(cyclopropylmethyl)-2-methylheptane-1,6-diamine
CID 65296045
3-cyclopentyl-N-ethyl-2-methylpropan-1-amine
CID 62528074
3-[cyclopropyl(cyclopropylmethyl)amino]-2-(propylamino)propanoic acid
CID 64521842
N-(2-bicyclo[2.2.1]heptanylmethyl)-N'-ethyl-N,2-dimethylpropane-1,3-diamine
CID 63681849
3-[cyclopropyl(cyclopropylmethyl)amino]-2-methylpropanethioamide
CID 64521353
N,2-dimethyl-N-(4-methylcyclohexyl)-N'-propylpropane-1,3-diamine
CID 55069274
ethyl 3-[cyclopropyl(cyclopropylmethyl)amino]-2-(propylamino)propanoate
CID 64522428
N-cyclopropyl-N'-ethyl-2-methylidene-N-(2-methylpropyl)propane-1,3-diamine
CID 103070025
1-[cyclohexyl(ethyl)amino]-3-(ethylamino)propan-2-ol
CID 43165783

Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-N-(cyclopropylmethyl)-N'-ethyl-2-methylpropane-1,3-diamine?
The IUPAC name of N-cyclopropyl-N-(cyclopropylmethyl)-N'-ethyl-2-methylpropane-1,3-diamine (CID 64520179) is N-cyclopropyl-N-(cyclopropylmethyl)-N'-ethyl-2-methylpropane-1,3-diamine.
What is the SMILES notation for N-cyclopropyl-N-(cyclopropylmethyl)-N'-ethyl-2-methylpropane-1,3-diamine?
The canonical SMILES for N-cyclopropyl-N-(cyclopropylmethyl)-N'-ethyl-2-methylpropane-1,3-diamine is CCNCC(C)CN(CC1CC1)C1CC1.
What is the InChIKey of N-cyclopropyl-N-(cyclopropylmethyl)-N'-ethyl-2-methylpropane-1,3-diamine?
The InChIKey is YGBFCISDDQNDAD-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H26N2/c1-3-14-8-11(2)9-15(13-6-7-13)10-12-4-5-12/h11-14H,3-10H2,1-2H3.
What are the key properties of N-cyclopropyl-N-(cyclopropylmethyl)-N'-ethyl-2-methylpropane-1,3-diamine?
N-cyclopropyl-N-(cyclopropylmethyl)-N'-ethyl-2-methylpropane-1,3-diamine has a molecular weight of 210.36 g/mol, XLogP of 2.11, 8 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-N-(cyclopropylmethyl)-N'-ethyl-2-methylpropane-1,3-diamine is sourced from PubChem (CID 64520179), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).