N-cyclopropyl-N-(cyclopropylmethyl)-4-(ethylaminomethyl)-3-fluoropyridin-2-amine

C15H22FN3 — CID 105390010

IUPACN-cyclopropyl-N-(cyclopropylmethyl)-4-(ethylaminomethyl)-3-fluoropyridin-2-amine
SMILESCCNCc1ccnc(N(CC2CC2)C2CC2)c1F
InChIInChI=1S/C15H22FN3/c1-2-17-9-12-7-8-18-15(14(12)16)19(13-5-6-13)10-11-3-4-11/h7-8,11,13,17H,2-6,9-10H2,1H3
InChIKeyRTLPEIYTLXFBRM-UHFFFAOYSA-N
MW263.36 g/mol
LogP2.71
Rot. Bonds7

About N-cyclopropyl-N-(cyclopropylmethyl)-4-(ethylaminomethyl)-3-fluoropyridin-2-amine

N-cyclopropyl-N-(cyclopropylmethyl)-4-(ethylaminomethyl)-3-fluoropyridin-2-amine (PubChem CID 105390010) has the molecular formula C15H22FN3 and a molecular weight of 263.36 g/mol. Its IUPAC name is N-cyclopropyl-N-(cyclopropylmethyl)-4-(ethylaminomethyl)-3-fluoropyridin-2-amine.

Molecular Properties

Compound NameN-cyclopropyl-N-(cyclopropylmethyl)-4-(ethylaminomethyl)-3-fluoropyridin-2-amine
PubChem CID105390010
Molecular FormulaC15H22FN3
Molecular Weight263.36 g/mol
Exact Mass263.18
IUPAC NameN-cyclopropyl-N-(cyclopropylmethyl)-4-(ethylaminomethyl)-3-fluoropyridin-2-amine
SMILESCCNCc1ccnc(N(CC2CC2)C2CC2)c1F
InChIInChI=1S/C15H22FN3/c1-2-17-9-12-7-8-18-15(14(12)16)19(13-5-6-13)10-11-3-4-11/h7-8,11,13,17H,2-6,9-10H2,1H3
InChIKeyRTLPEIYTLXFBRM-UHFFFAOYSA-N
XLogP2.71
TPSA28.16 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.36
LogP ≤ 52.71
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N,N-bis(cyclopropylmethyl)-4-(ethylaminomethyl)-3-fluoropyridin-2-amine
CID 105389989
N-(cyclopropylmethyl)-4-(ethylaminomethyl)-3-fluoro-N-propan-2-ylpyridin-2-amine
CID 105389642
4-(ethylaminomethyl)-3-fluoro-N-methyl-N-[(1-methylpyrrolidin-3-yl)methyl]pyridin-2-amine
CID 105389860
N-(2-bicyclo[2.2.1]heptanylmethyl)-4-(ethylaminomethyl)-3-fluoro-N-methylpyridin-2-amine
CID 105389902
N-cyclopropyl-N-(cyclopropylmethyl)-4-(ethylaminomethyl)pyridin-2-amine
CID 64520876
N-cyclopropyl-N-(cyclopropylmethyl)-2-(ethylaminomethyl)pyridin-4-amine
CID 64520480
N-cyclopropyl-3-fluoro-4-(methylaminomethyl)-N-(2-methylpropyl)pyridin-2-amine
CID 105389388
N-cyclopropyl-3-fluoro-N-(3-methylbutyl)-4-[(propan-2-ylamino)methyl]pyridin-2-amine
CID 105389656
4-(chloromethyl)-N-cyclopropyl-N-ethyl-3-fluoropyridin-2-amine
CID 105383476
N'-[4-(ethylaminomethyl)-3-fluoro-2-pyridinyl]-N,N,N'-trimethylethane-1,2-diamine
CID 105389911
4-(ethylaminomethyl)-N-[(1-ethylpyrrolidin-2-yl)methyl]-3-fluoro-N-methylpyridin-2-amine
CID 105390101
N-[[3-fluoro-2-(2-methylcyclohexyl)oxy-4-pyridinyl]methyl]ethanamine
CID 105390828

Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-N-(cyclopropylmethyl)-4-(ethylaminomethyl)-3-fluoropyridin-2-amine?
The IUPAC name of N-cyclopropyl-N-(cyclopropylmethyl)-4-(ethylaminomethyl)-3-fluoropyridin-2-amine (CID 105390010) is N-cyclopropyl-N-(cyclopropylmethyl)-4-(ethylaminomethyl)-3-fluoropyridin-2-amine.
What is the SMILES notation for N-cyclopropyl-N-(cyclopropylmethyl)-4-(ethylaminomethyl)-3-fluoropyridin-2-amine?
The canonical SMILES for N-cyclopropyl-N-(cyclopropylmethyl)-4-(ethylaminomethyl)-3-fluoropyridin-2-amine is CCNCc1ccnc(N(CC2CC2)C2CC2)c1F.
What is the InChIKey of N-cyclopropyl-N-(cyclopropylmethyl)-4-(ethylaminomethyl)-3-fluoropyridin-2-amine?
The InChIKey is RTLPEIYTLXFBRM-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22FN3/c1-2-17-9-12-7-8-18-15(14(12)16)19(13-5-6-13)10-11-3-4-11/h7-8,11,13,17H,2-6,9-10H2,1H3.
What are the key properties of N-cyclopropyl-N-(cyclopropylmethyl)-4-(ethylaminomethyl)-3-fluoropyridin-2-amine?
N-cyclopropyl-N-(cyclopropylmethyl)-4-(ethylaminomethyl)-3-fluoropyridin-2-amine has a molecular weight of 263.36 g/mol, XLogP of 2.71, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-N-(cyclopropylmethyl)-4-(ethylaminomethyl)-3-fluoropyridin-2-amine is sourced from PubChem (CID 105390010), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).